ethyl 2-butyl-3-[(2-carboxyoxy-3-phenyl-phenyl)methyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-butyl-3-[(2-carboxyoxy-3-phenyl-phenyl)methyl]benzimidazole-5-carboxylate Openeye Name: ethyl 2-butyl-3-[(2-carboxyoxy-3-phenyl-phenyl)methyl]benzimidazole-5-carboxylate CAS Name: 2-butyl-3-[(2-carboxyoxy-3-phenylphenyl)methyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-3-[(2-carboxyoxy-3-phenylphenyl)methyl]benzimidazole-5-carboxylate Traditional Name: 2-butyl-3-(2-carboxyoxy-3-phenyl-benzyl)benzimidazole-5-carboxylic acid ethyl ester Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=C(C=C2)C(=O)OCC

InChI

InChI=1S/C28H28N2O5/c1-3-5-14-25-29-23-16-15-20(27(31)34-4-2)17-24(23)30(25)18-21-12-9-13-22(26(21)35-28(32)33)19-10-7-6-8-11-19/h6-13,15-17H,3-5,14,18H2,1-2H3,(H,32,33)