1-cyclopentyl-2-[4-[(2,4-dimethylphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[4-[(2,4-dimethylphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[4-[(2,4-dimethylphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[4-[(2,4-dimethylanilino)-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[4-[(2,4-dimethylphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[4-[(2,4-dimethylphenyl)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)NC(=O)C2=CC=C(C=C2)C3=NC4=C(N3C5CCCC5)C=CC(=C4)C(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C28H27N3O3/c1-17-7-13-23(18(2)15-17)30-27(32)20-10-8-19(9-11-20)26-29-24-16-21(28(33)34)12-14-25(24)31(26)22-5-3-4-6-22/h7-16,22H,3-6H2,1-2H3,(H,30,32)(H,33,34)