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

Systemtic Name: 1-cyclopentyl-2-[4-[(4-methylphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[4-(p-tolylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[4-[(4-methylanilino)-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[4-[(4-methylphenyl)carbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[4-(p-tolylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Formula: C27H25N3O3 MolecularWeight: 439.5057

Click to see the large picture

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N3O3/c1-17-6-13-21(14-7-17)28-26(31)19-10-8-18(9-11-19)25-29-23-16-20(27(32)33)12-15-24(23)30(25)22-4-2-3-5-22/h6-16,22H,2-5H2,1H3,(H,28,31)(H,32,33)