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

Systemtic Name: 3-[[4-(2-butoxycarbonylphenyl)phenyl]methyl]-2-butyl-5-(2-oxidanylpropan-2-yl)imidazole-4-carboxylic acid Openeye Name: 3-[[4-(2-butoxycarbonylphenyl)phenyl]methyl]-2-butyl-5-(1-hydroxy-1-methyl-ethyl)imidazole-4-carboxylic acid CAS Name: 3-[[4-[2-[butoxy(oxo)methyl]phenyl]phenyl]methyl]-2-butyl-5-(2-hydroxypropan-2-yl)-4-imidazolecarboxylic acid IUPAC Name: 3-[[4-(2-butoxycarbonylphenyl)phenyl]methyl]-2-butyl-5-(2-hydroxypropan-2-yl)imidazole-4-carboxylic acid Traditional Name: 3-[4-(2-butoxycarbonylphenyl)benzyl]-2-butyl-5-(1-hydroxy-1-methyl-ethyl)imidazole-4-carboxylic acid Formula: C29H36N2O5 MolecularWeight: 492.60654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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