SDF/Mol File of Indazolo[3,2-a]isoquinoline-6-amine (C15H11N3)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying Indazolo[3,2-a]isoquinoline-6-amine Molecule

• Chemical structure of Indazolo[3,2-a]isoquinoline-6-amine

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of Indazolo[3,2-a]isoquinoline-6-amine is available in chemical structure page of Indazolo[3,2-a]isoquinoline-6-amine, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of Indazolo[3,2-a]isoquinoline-6-amine

  The molecular weight of Indazolo[3,2-a]isoquinoline-6-amine is available in molecular weight page of Indazolo[3,2-a]isoquinoline-6-amine, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.

• Chemical formula of Indazolo[3,2-a]isoquinoline-6-amine

  The chemical formula of Indazolo[3,2-a]isoquinoline-6-amine is given in chemical formula page of Indazolo[3,2-a]isoquinoline-6-amine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• InChI (IUPAC International Chemical Identifier) information of Indazolo[3,2-a]isoquinoline-6-amine

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of Indazolo[3,2-a]isoquinoline-6-amine is:

  InChI=1S/C15H11N3/c16-14-9-10-5-1-2-6-11(10)15-12-7-3-4-8-13(12)17-18(14)15/h1-9H,16H2

  It can provide a standard way to encode the molecular information of Indazolo[3,2-a]isoquinoline-6-amine to facilitate the search for the compound information in databases and on the web.

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of Indazolo[3,2-a]isoquinoline-6-amine is:

  InChIKey=WWALJEVHFHPBDX-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for Indazolo[3,2-a]isoquinoline-6-amine, but it needs to be linked to the full InChI to get back to the original structure of the Indazolo[3,2-a]isoquinoline-6-amine since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of Indazolo[3,2-a]isoquinoline-6-amine

  The Indazolo[3,2-a]isoquinoline-6-amine compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of Indazolo[3,2-a]isoquinoline-6-amine including the registry numbers are listed below, if available:

  • Indazolo[3,2-a]isoquinoline-6-amine

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Indazolo[3,2-a]isoquinoline-6-amine Identification Summary Frequently Asked Questions (FAQs)

What’s the Indazolo[3,2-a]isoquinoline-6-amine formula?
C15H11N3
How many atoms and what elements are included in the Indazolo[3,2-a]isoquinoline-6-amine molecule?
29 atom(s) - 11 Hydrogen atom(s), 15 Carbon atom(s), and 3 Nitrogen atom(s)
How many chemical bonds and what kind of bonds are in the Indazolo[3,2-a]isoquinoline-6-amine structure?
32 bond(s) - 21 non-H bond(s), 20 multiple bond(s), 20 aromatic bond(s), 1 five-membered ring(s), 3 six-membered ring(s), 2 nine-membered ring(s), 1 ten-membered ring(s), 1 primary amine(s) (aromatic), 1 Pyrazole(s), and 1 Pyridine(s)
What’s the Indazolo[3,2-a]isoquinoline-6-amine’s molar mass?
233.26794 g/mol
What’s the SMILES structure of Indazolo[3,2-a]isoquinoline-6-amine?
Nc3cc1ccccc1c4c2ccccc2nn34
What’s the InChI code of Indazolo[3,2-a]isoquinoline-6-amine?
InChI=1S/C15H11N3/c16-14-9-10-5-1-2-6-11(10)15-12-7-3-4-8-13(12)17-18(14)15/h1-9H,16H2
What’s the InChIKey format of Indazolo[3,2-a]isoquinoline-6-amine?
WWALJEVHFHPBDX-UHFFFAOYSA-N

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Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).