2-[3-[(4-butoxyphenyl)carbamoyl]phenyl]-1-cyclopentyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[3-[(4-butoxyphenyl)carbamoyl]phenyl]-1-cyclopentyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[3-[(4-butoxyphenyl)carbamoyl]phenyl]-1-cyclopentyl-benzimidazole-5-carboxylic acid CAS Name: 2-[3-[(4-butoxyanilino)-oxomethyl]phenyl]-1-cyclopentyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[3-[(4-butoxyphenyl)carbamoyl]phenyl]-1-cyclopentylbenzimidazole-5-carboxylic acid Traditional Name: 2-[3-[(4-butoxyphenyl)carbamoyl]phenyl]-1-cyclopentyl-benzimidazole-5-carboxylic acid Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C2=CC=CC(=C2)C3=NC4=C(N3C5CCCC5)C=CC(=C4)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C2=CC=CC(=C2)C3=NC4=C(N3C5CCCC5)C=CC(=C4)C(=O)O

InChI

InChI=1S/C30H31N3O4/c1-2-3-17-37-25-14-12-23(13-15-25)31-29(34)21-8-6-7-20(18-21)28-32-26-19-22(30(35)36)11-16-27(26)33(28)24-9-4-5-10-24/h6-8,11-16,18-19,24H,2-5,9-10,17H2,1H3,(H,31,34)(H,35,36)