3-[(E)-N-(6-azanylpyridin-2-yl)-C-methyl-carbonimidoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one

Systemtic Name: 3-[(E)-N-(6-azanylpyridin-2-yl)-C-methyl-carbonimidoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 3-[(E)-N-(6-amino-2-pyridyl)-C-methyl-carbonimidoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one CAS Name: 3-[(1E)-1-[(6-amino-2-pyridinyl)imino]ethyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one IUPAC Name: 3-[(E)-N-(6-aminopyridin-2-yl)-C-methylcarbonimidoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one Traditional Name: 3-[(E)-N-(6-amino-2-pyridyl)-C-methyl-carbonimidoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one Formula: C17H17N4O2+ MolecularWeight: 309.34248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=NC(=CC=C1)N)C2C(=O)C3=CC=CC=C3[N+](=C2O)C

Isomeric SMILES

C/C(=N\C1=NC(=CC=C1)N)/C2C(=O)C3=CC=CC=C3[N+](=C2O)C

InChI

InChI=1S/C17H16N4O2/c1-10(19-14-9-5-8-13(18)20-14)15-16(22)11-6-3-4-7-12(11)21(2)17(15)23/h3-9,15H,1-2H3,(H2,18,20)/p+1/b19-10+