4-[(4-tert-butylphenyl)carbonylamino]-1-cyclopentyl-2-phenyl-benzimidazole-5-carboxylic acid

Systemtic Name: 4-[(4-tert-butylphenyl)carbonylamino]-1-cyclopentyl-2-phenyl-benzimidazole-5-carboxylic acid Openeye Name: 4-[(4-tert-butylbenzoyl)amino]-1-cyclopentyl-2-phenyl-benzimidazole-5-carboxylic acid CAS Name: 4-[[(4-tert-butylphenyl)-oxomethyl]amino]-1-cyclopentyl-2-phenyl-5-benzimidazolecarboxylic acid IUPAC Name: 4-[(4-tert-butylbenzoyl)amino]-1-cyclopentyl-2-phenylbenzimidazole-5-carboxylic acid Traditional Name: 4-[(4-tert-butylbenzoyl)amino]-1-cyclopentyl-2-phenyl-benzimidazole-5-carboxylic acid Formula: C30H31N3O3 MolecularWeight: 481.58544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC3=C2N=C(N3C4CCCC4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC3=C2N=C(N3C4CCCC4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C30H31N3O3/c1-30(2,3)21-15-13-20(14-16-21)28(34)32-25-23(29(35)36)17-18-24-26(25)31-27(19-9-5-4-6-10-19)33(24)22-11-7-8-12-22/h4-6,9-10,13-18,22H,7-8,11-12H2,1-3H3,(H,32,34)(H,35,36)