2-butyl-1-[(3-carboxyoxy-4-phenyl-phenyl)methyl]benzimidazole-5-carboxylic acid

Systemtic Name: 2-butyl-1-[(3-carboxyoxy-4-phenyl-phenyl)methyl]benzimidazole-5-carboxylic acid Openeye Name: 2-butyl-1-[(3-carboxyoxy-4-phenyl-phenyl)methyl]benzimidazole-5-carboxylic acid CAS Name: 2-butyl-1-[(3-carboxyoxy-4-phenylphenyl)methyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-butyl-1-[(3-carboxyoxy-4-phenylphenyl)methyl]benzimidazole-5-carboxylic acid Traditional Name: 2-butyl-1-(3-carboxyoxy-4-phenyl-benzyl)benzimidazole-5-carboxylic acid Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C=CC(=C2)C(=O)O

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C=CC(=C2)C(=O)O

InChI

InChI=1S/C26H24N2O5/c1-2-3-9-24-27-21-15-19(25(29)30)11-13-22(21)28(24)16-17-10-12-20(18-7-5-4-6-8-18)23(14-17)33-26(31)32/h4-8,10-15H,2-3,9,16H2,1H3,(H,29,30)(H,31,32)