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

Systemtic Name: 1-cyclohexyl-2-[(2Z)-2-(2,4-dimethoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[(2Z)-2-(2,4-dimethoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[(2Z)-2-(2,4-dimethoxy-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinolin-6-yl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[(2Z)-2-(2,4-dimethoxy-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[(2Z)-2-(6-keto-2,4-dimethoxy-cyclohexa-2,4-dien-1-ylidene)-1H-quinolin-6-yl]benzimidazole-5-carboxylic acid Formula: C31H29N3O5 MolecularWeight: 523.57906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C=CC3=C(N2)C=CC(=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)C(=C1)OC

Isomeric SMILES

COC1=CC(=O)/C(=C\2/C=CC3=C(N2)C=CC(=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)/C(=C1)OC

InChI

InChI=1S/C31H29N3O5/c1-38-22-16-27(35)29(28(17-22)39-2)24-12-8-18-14-19(9-11-23(18)32-24)30-33-25-15-20(31(36)37)10-13-26(25)34(30)21-6-4-3-5-7-21/h8-17,21,32H,3-7H2,1-2H3,(H,36,37)/b29-24+