3-[[4-[2-(carboxycarbonyl)phenyl]phenyl]methyl]-2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-5-(2-oxidanylpropan-2-yl)imidazole-4-carboxylic acid

Systemtic Name: 3-[[4-[2-(carboxycarbonyl)phenyl]phenyl]methyl]-2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-5-(2-oxidanylpropan-2-yl)imidazole-4-carboxylic acid Openeye Name: 2-[[tert-butoxycarbonyl(methyl)amino]methyl]-5-(1-hydroxy-1-methyl-ethyl)-3-[[4-(2-oxalophenyl)phenyl]methyl]imidazole-4-carboxylic acid CAS Name: 5-(2-hydroxypropan-2-yl)-2-[[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-3-[[4-(2-oxalophenyl)phenyl]methyl]-4-imidazolecarboxylic acid IUPAC Name: 5-(2-hydroxypropan-2-yl)-2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]-3-[[4-(2-oxalophenyl)phenyl]methyl]imidazole-4-carboxylic acid Traditional Name: 2-[[tert-butoxycarbonyl(methyl)amino]methyl]-5-(1-hydroxy-1-methyl-ethyl)-3-[4-(2-oxalophenyl)benzyl]imidazole-4-carboxylic acid Formula: C29H33N3O8 MolecularWeight: 551.58762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)CC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)C(=O)O)C(=O)O)C(C)(C)O

Isomeric SMILES

CC(C)(C)OC(=O)N(C)CC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)C(=O)O)C(=O)O)C(C)(C)O

InChI

InChI=1S/C29H33N3O8/c1-28(2,3)40-27(38)31(6)16-21-30-24(29(4,5)39)22(25(34)35)32(21)15-17-11-13-18(14-12-17)19-9-7-8-10-20(19)23(33)26(36)37/h7-14,39H,15-16H2,1-6H3,(H,34,35)(H,36,37)