[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl 2-butyl-4-(hydroxymethyl)imidazole-4-carboxylate

Systemtic Name: [3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl 2-butyl-4-(hydroxymethyl)imidazole-4-carboxylate Openeye Name: (3-tert-butoxycarbonyl-4-phenyl-phenyl)methyl 2-butyl-4-(hydroxymethyl)imidazole-4-carboxylate CAS Name: 2-butyl-4-(hydroxymethyl)-4-imidazolecarboxylic acid [3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]methyl ester IUPAC Name: [3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]methyl 2-butyl-4-(hydroxymethyl)imidazole-4-carboxylate Traditional Name: 2-butyl-4-methylol-imidazole-4-carboxylic acid (3-tert-butoxycarbonyl-4-phenyl-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=C3)C(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

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