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

Systemtic Name: 2-butyl-1-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl]-5-(2-oxidanylpropan-2-yl)imidazole-4-carboxylic acid Openeye Name: 1-[(3-tert-butoxycarbonyl-4-phenyl-phenyl)methyl]-2-butyl-5-(1-hydroxy-1-methyl-ethyl)imidazole-4-carboxylic acid CAS Name: 2-butyl-5-(2-hydroxypropan-2-yl)-1-[[3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]methyl]-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-5-(2-hydroxypropan-2-yl)-1-[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]methyl]imidazole-4-carboxylic acid Traditional Name: 1-(3-tert-butoxycarbonyl-4-phenyl-benzyl)-2-butyl-5-(1-hydroxy-1-methyl-ethyl)imidazole-4-carboxylic acid Formula: C29H36N2O5 MolecularWeight: 492.60654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=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

CCCCC1=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/C29H36N2O5/c1-7-8-14-23-30-24(26(32)33)25(29(5,6)35)31(23)18-19-15-16-21(20-12-10-9-11-13-20)22(17-19)27(34)36-28(2,3)4/h9-13,15-17,35H,7-8,14,18H2,1-6H3,(H,32,33)