3-[(3-methylphenyl)methyl]-2-propyl-benzimidazole-5-carboxylic acid

Systemtic Name: 3-[(3-methylphenyl)methyl]-2-propyl-benzimidazole-5-carboxylic acid Openeye Name: 3-(m-tolylmethyl)-2-propyl-benzimidazole-5-carboxylic acid CAS Name: 3-[(3-methylphenyl)methyl]-2-propyl-5-benzimidazolecarboxylic acid IUPAC Name: 3-[(3-methylphenyl)methyl]-2-propylbenzimidazole-5-carboxylic acid Traditional Name: 3-(3-methylbenzyl)-2-propyl-benzimidazole-5-carboxylic acid Formula: C19H20N2O2 MolecularWeight: 308.3743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1CC3=CC=CC(=C3)C)C=C(C=C2)C(=O)O

Isomeric SMILES

CCCC1=NC2=C(N1CC3=CC=CC(=C3)C)C=C(C=C2)C(=O)O

InChI

InChI=1S/C19H20N2O2/c1-3-5-18-20-16-9-8-15(19(22)23)11-17(16)21(18)12-14-7-4-6-13(2)10-14/h4,6-11H,3,5,12H2,1-2H3,(H,22,23)