[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl 5-methanoyl-2-propyl-1H-imidazole-4-carboxylate

Systemtic Name: [3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]methyl 5-methanoyl-2-propyl-1H-imidazole-4-carboxylate Openeye Name: (3-tert-butoxycarbonyl-4-phenyl-phenyl)methyl 5-formyl-2-propyl-1H-imidazole-4-carboxylate CAS Name: 5-formyl-2-propyl-1H-imidazole-4-carboxylic acid [3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]methyl ester IUPAC Name: [3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]methyl 5-formyl-2-propyl-1H-imidazole-4-carboxylate Traditional Name: 5-formyl-2-propyl-1H-imidazole-4-carboxylic acid (3-tert-butoxycarbonyl-4-phenyl-benzyl) ester Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1)C=O)C(=O)OCC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=NC(=C(N1)C=O)C(=O)OCC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H28N2O5/c1-5-9-22-27-21(15-29)23(28-22)25(31)32-16-17-12-13-19(18-10-7-6-8-11-18)20(14-17)24(30)33-26(2,3)4/h6-8,10-15H,5,9,16H2,1-4H3,(H,27,28)