[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl 2-butyl-4-(hydroxymethyl)imidazole-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C=N1)(CO)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=NC(C=N1)(CO)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C

InChI

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