1-cyclopentyl-2-[3-[(4-methylphenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[3-[(4-methylphenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[3-(p-tolylmethylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[3-[[(4-methylphenyl)methylamino]-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[3-[(4-methylphenyl)methylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[3-[(4-methylbenzyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC(=C2)C3=NC4=C(N3C5CCCC5)C=CC(=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC=CC(=C2)C3=NC4=C(N3C5CCCC5)C=CC(=C4)C(=O)O

InChI

InChI=1S/C28H27N3O3/c1-18-9-11-19(12-10-18)17-29-27(32)21-6-4-5-20(15-21)26-30-24-16-22(28(33)34)13-14-25(24)31(26)23-7-2-3-8-23/h4-6,9-16,23H,2-3,7-8,17H2,1H3,(H,29,32)(H,33,34)