[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl 2-butyl-5-(2,2-dimethyl-1-oxidanyl-propyl)-1H-imidazole-4-carboxylate

Systemtic Name: [3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl 2-butyl-5-(2,2-dimethyl-1-oxidanyl-propyl)-1H-imidazole-4-carboxylate Openeye Name: (3-tert-butoxycarbonyl-4-phenyl-phenyl)methyl 2-butyl-5-(1-hydroxy-2,2-dimethyl-propyl)-1H-imidazole-4-carboxylate CAS Name: 2-butyl-5-(1-hydroxy-2,2-dimethylpropyl)-1H-imidazole-4-carboxylic acid [3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]methyl ester IUPAC Name: [3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]methyl 2-butyl-5-(1-hydroxy-2,2-dimethylpropyl)-1H-imidazole-4-carboxylate Traditional Name: 2-butyl-5-(1-hydroxy-2,2-dimethyl-propyl)-1H-imidazole-4-carboxylic acid (3-tert-butoxycarbonyl-4-phenyl-benzyl) ester Formula: C31H40N2O5 MolecularWeight: 520.6597

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)C(C(C)(C)C)O)C(=O)OCC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=NC(=C(N1)C(C(C)(C)C)O)C(=O)OCC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H40N2O5/c1-8-9-15-24-32-25(27(34)30(2,3)4)26(33-24)29(36)37-19-20-16-17-22(21-13-11-10-12-14-21)23(18-20)28(35)38-31(5,6)7/h10-14,16-18,27,34H,8-9,15,19H2,1-7H3,(H,32,33)