tert-butyl 4-(4-nitroimidazol-1-yl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-nitroimidazol-1-yl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-nitroimidazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(4-nitro-1-imidazolyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-nitroimidazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(4-nitroimidazol-1-yl)piperidine-1-carboxylic acid tert-butyl ester Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H20N4O4/c1-13(2,3)21-12(18)15-6-4-10(5-7-15)16-8-11(14-9-16)17(19)20/h8-10H,4-7H2,1-3H3