1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazole-5-carboxylic acid Openeye Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazole-5-carboxylic acid CAS Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)methyl]benzimidazole-5-carboxylic acid Traditional Name: 1-(cyclopropylmethyl)-2-(4-ethoxybenzyl)benzimidazole-5-carboxylic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NC3=C(N2CC4CC4)C=CC(=C3)C(=O)O

InChI

InChI=1S/C21H22N2O3/c1-2-26-17-8-5-14(6-9-17)11-20-22-18-12-16(21(24)25)7-10-19(18)23(20)13-15-3-4-15/h5-10,12,15H,2-4,11,13H2,1H3,(H,24,25)