tert-butyl 4-[[(3-nitropyridin-4-yl)amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(3-nitropyridin-4-yl)amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(3-nitro-4-pyridyl)amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[(3-nitro-4-pyridinyl)amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(3-nitropyridin-4-yl)amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[(3-nitro-4-pyridyl)amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C16H24N4O4 MolecularWeight: 336.38616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CNC2=C(C=NC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CNC2=C(C=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H24N4O4/c1-16(2,3)24-15(21)19-8-5-12(6-9-19)10-18-13-4-7-17-11-14(13)20(22)23/h4,7,11-12H,5-6,8-10H2,1-3H3,(H,17,18)