tert-butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-nitro-3-pyridyl)piperazine-1-carboxylate CAS Name: 4-(6-nitro-3-pyridinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate Traditional Name: 4-(6-nitro-3-pyridyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C14H20N4O4 MolecularWeight: 308.333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CN=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CN=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O4/c1-14(2,3)22-13(19)17-8-6-16(7-9-17)11-4-5-12(15-10-11)18(20)21/h4-5,10H,6-9H2,1-3H3