3-azanyl-2-(4,6,8-trimethylquinolin-2-yl)-1H-pyrazol-2-ium-4-carbonitrile

Systemtic Name: 3-azanyl-2-(4,6,8-trimethylquinolin-2-yl)-1H-pyrazol-2-ium-4-carbonitrile Openeye Name: 3-amino-2-(4,6,8-trimethyl-2-quinolyl)-1H-pyrazol-2-ium-4-carbonitrile CAS Name: 3-amino-2-(4,6,8-trimethyl-2-quinolinyl)-1H-pyrazol-2-ium-4-carbonitrile IUPAC Name: 3-amino-2-(4,6,8-trimethylquinolin-2-yl)-1H-pyrazol-2-ium-4-carbonitrile Traditional Name: 3-amino-2-(4,6,8-trimethyl-2-quinolyl)-1H-pyrazol-2-ium-4-carbonitrile Formula: C16H16N5+ MolecularWeight: 278.33174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)[N+]3=C(C(=CN3)C#N)N)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)[N+]3=C(C(=CN3)C#N)N)C)C

InChI

InChI=1S/C16H15N5/c1-9-4-11(3)15-13(5-9)10(2)6-14(20-15)21-16(18)12(7-17)8-19-21/h4-6,8H,1-3H3,(H2,18,19)/p+1