1-cyclopentyl-2-[3-(2,2-dimethylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclopentyl-2-[3-(2,2-dimethylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclopentyl-2-[3-(2,2-dimethylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclopentyl-2-[3-[(2,2-dimethylpropylamino)-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclopentyl-2-[3-(2,2-dimethylpropylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclopentyl-2-[3-(neopentylcarbamoyl)phenyl]benzimidazole-5-carboxylic acid Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=CC=CC(=C1)C2=NC3=C(N2C4CCCC4)C=CC(=C3)C(=O)O

Isomeric SMILES

CC(C)(C)CNC(=O)C1=CC=CC(=C1)C2=NC3=C(N2C4CCCC4)C=CC(=C3)C(=O)O

InChI

InChI=1S/C25H29N3O3/c1-25(2,3)15-26-23(29)17-8-6-7-16(13-17)22-27-20-14-18(24(30)31)11-12-21(20)28(22)19-9-4-5-10-19/h6-8,11-14,19H,4-5,9-10,15H2,1-3H3,(H,26,29)(H,30,31)