1-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl]-5-(2-oxidanylpropan-2-yl)-2-propyl-imidazole-4-carboxylic acid

Systemtic Name: 1-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl]-5-(2-oxidanylpropan-2-yl)-2-propyl-imidazole-4-carboxylic acid Openeye Name: 1-[(3-tert-butoxycarbonyl-4-phenyl-phenyl)methyl]-5-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazole-4-carboxylic acid CAS Name: 5-(2-hydroxypropan-2-yl)-1-[[3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]methyl]-2-propyl-4-imidazolecarboxylic acid IUPAC Name: 5-(2-hydroxypropan-2-yl)-1-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]methyl]-2-propylimidazole-4-carboxylic acid Traditional Name: 1-(3-tert-butoxycarbonyl-4-phenyl-benzyl)-5-(1-hydroxy-1-methyl-ethyl)-2-propyl-imidazole-4-carboxylic acid Formula: C28H34N2O5 MolecularWeight: 478.57996

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C)C(C)(C)O)C(=O)O

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C)C(C)(C)O)C(=O)O

InChI

InChI=1S/C28H34N2O5/c1-7-11-22-29-23(25(31)32)24(28(5,6)34)30(22)17-18-14-15-20(19-12-9-8-10-13-19)21(16-18)26(33)35-27(2,3)4/h8-10,12-16,34H,7,11,17H2,1-6H3,(H,31,32)