2-butyl-5-(hydroxymethyl)-1-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]imidazole-4-carboxylic acid

Systemtic Name: 2-butyl-5-(hydroxymethyl)-1-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]imidazole-4-carboxylic acid Openeye Name: 1-[[4-(2-tert-butoxycarbonylphenyl)phenyl]methyl]-2-butyl-5-(hydroxymethyl)imidazole-4-carboxylic acid CAS Name: 2-butyl-5-(hydroxymethyl)-1-[[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]methyl]-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-5-(hydroxymethyl)-1-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]imidazole-4-carboxylic acid Traditional Name: 1-[4-(2-tert-butoxycarbonylphenyl)benzyl]-2-butyl-5-methylol-imidazole-4-carboxylic acid Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)CO)C(=O)O

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)CO)C(=O)O

InChI

InChI=1S/C27H32N2O5/c1-5-6-11-23-28-24(25(31)32)22(17-30)29(23)16-18-12-14-19(15-13-18)20-9-7-8-10-21(20)26(33)34-27(2,3)4/h7-10,12-15,30H,5-6,11,16-17H2,1-4H3,(H,31,32)