tert-butyl 4-[4-(acetyloxymethyl)phenyl]-2-(4-nitrophenyl)-1H-imidazole-5-carboxylate

Systemtic Name: tert-butyl 4-[4-(acetyloxymethyl)phenyl]-2-(4-nitrophenyl)-1H-imidazole-5-carboxylate Openeye Name: tert-butyl 4-[4-(acetoxymethyl)phenyl]-2-(4-nitrophenyl)-1H-imidazole-5-carboxylate CAS Name: 4-[4-(acetyloxymethyl)phenyl]-2-(4-nitrophenyl)-1H-imidazole-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(acetyloxymethyl)phenyl]-2-(4-nitrophenyl)-1H-imidazole-5-carboxylate Traditional Name: 4-[4-(acetoxymethyl)phenyl]-2-(4-nitrophenyl)-1H-imidazole-5-carboxylic acid tert-butyl ester Formula: C23H23N3O6 MolecularWeight: 437.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC=C(C=C1)C2=C(NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)OCC1=CC=C(C=C1)C2=C(NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C23H23N3O6/c1-14(27)31-13-15-5-7-16(8-6-15)19-20(22(28)32-23(2,3)4)25-21(24-19)17-9-11-18(12-10-17)26(29)30/h5-12H,13H2,1-4H3,(H,24,25)