3-[[4-[2-(carboxycarbonyl)phenyl]phenyl]methyl]-2-ethyl-benzimidazole-4-carboxylic acid

Systemtic Name: 3-[[4-[2-(carboxycarbonyl)phenyl]phenyl]methyl]-2-ethyl-benzimidazole-4-carboxylic acid Openeye Name: 2-ethyl-3-[[4-(2-oxalophenyl)phenyl]methyl]benzimidazole-4-carboxylic acid CAS Name: 2-ethyl-3-[[4-(2-oxalophenyl)phenyl]methyl]-4-benzimidazolecarboxylic acid IUPAC Name: 2-ethyl-3-[[4-(2-oxalophenyl)phenyl]methyl]benzimidazole-4-carboxylic acid Traditional Name: 2-ethyl-3-[4-(2-oxalophenyl)benzyl]benzimidazole-4-carboxylic acid Formula: C25H20N2O5 MolecularWeight: 428.4367

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)C(=O)O)C(=O)O

Isomeric SMILES

CCC1=NC2=CC=CC(=C2N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)C(=O)O)C(=O)O

InChI

InChI=1S/C25H20N2O5/c1-2-21-26-20-9-5-8-19(24(29)30)22(20)27(21)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)23(28)25(31)32/h3-13H,2,14H2,1H3,(H,29,30)(H,31,32)