tert-butyl 4-(3-nitrophenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-nitrophenyl)-2-(2-oxidanylidene-1H-imidazol-3-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(3-nitrophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate CAS Name: 4-(3-nitrophenyl)-2-(2-oxo-1H-imidazol-3-yl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-nitrophenyl)-2-(2-oxo-1H-imidazol-3-yl)piperidine-1-carboxylate Traditional Name: 2-(2-keto-4-imidazolin-1-yl)-4-(3-nitrophenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1N2C=CNC2=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O5/c1-19(2,3)28-18(25)22-9-7-14(12-16(22)21-10-8-20-17(21)24)13-5-4-6-15(11-13)23(26)27/h4-6,8,10-11,14,16H,7,9,12H2,1-3H3,(H,20,24)