1-cyclohexyl-2-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[4-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[4-(homoveratrylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Formula: C31H33N3O5 MolecularWeight: 527.61082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)C3=NC4=C(N3C5CCCCC5)C=CC(=C4)C(=O)O)OC

InChI

InChI=1S/C31H33N3O5/c1-38-27-15-8-20(18-28(27)39-2)16-17-32-30(35)22-11-9-21(10-12-22)29-33-25-19-23(31(36)37)13-14-26(25)34(29)24-6-4-3-5-7-24/h8-15,18-19,24H,3-7,16-17H2,1-2H3,(H,32,35)(H,36,37)