1-cyclohexyl-2-[(2Z)-2-(3-methyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[(2Z)-2-(3-methyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[(2Z)-2-(3-methyl-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[(2Z)-2-(3-methyl-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinolin-6-yl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[(2Z)-2-(3-methyl-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[(2Z)-2-(6-keto-3-methyl-5-nitro-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid Formula: C30H26N4O5 MolecularWeight: 522.55124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC3=C(N2)C=CC(=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)C(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

CC1=C/C(=C/2\C=CC3=C(N2)C=CC(=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)/C(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C30H26N4O5/c1-17-13-22(28(35)27(14-17)34(38)39)24-11-7-18-15-19(8-10-23(18)31-24)29-32-25-16-20(30(36)37)9-12-26(25)33(29)21-5-3-2-4-6-21/h7-16,21,31H,2-6H2,1H3,(H,36,37)/b24-22-