2-butyl-3-[[2-[(2-methylpropan-2-yl)oxycarbonyloxy]-3-phenyl-phenyl]methyl]benzimidazole-5-carboxylic acid

Systemtic Name: 2-butyl-3-[[2-[(2-methylpropan-2-yl)oxycarbonyloxy]-3-phenyl-phenyl]methyl]benzimidazole-5-carboxylic acid Openeye Name: 3-[(2-tert-butoxycarbonyloxy-3-phenyl-phenyl)methyl]-2-butyl-benzimidazole-5-carboxylic acid CAS Name: 2-butyl-3-[[2-[(2-methylpropan-2-yl)oxy-oxomethoxy]-3-phenylphenyl]methyl]-5-benzimidazolecarboxylic acid IUPAC Name: 2-butyl-3-[[2-[(2-methylpropan-2-yl)oxycarbonyloxy]-3-phenylphenyl]methyl]benzimidazole-5-carboxylic acid Traditional Name: 3-(2-tert-butoxycarbonyloxy-3-phenyl-benzyl)-2-butyl-benzimidazole-5-carboxylic acid Formula: C30H32N2O5 MolecularWeight: 500.58548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H32N2O5/c1-5-6-15-26-31-24-17-16-21(28(33)34)18-25(24)32(26)19-22-13-10-14-23(20-11-8-7-9-12-20)27(22)36-29(35)37-30(2,3)4/h7-14,16-18H,5-6,15,19H2,1-4H3,(H,33,34)