ethyl 4-(6-azanyl-3-nitro-pyridin-2-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(6-azanyl-3-nitro-pyridin-2-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(6-amino-3-nitro-2-pyridyl)piperazine-1-carboxylate CAS Name: 4-(6-amino-3-nitro-2-pyridinyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(6-amino-3-nitropyridin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(6-amino-3-nitro-2-pyridyl)piperazine-1-carboxylic acid ethyl ester Formula: C12H17N5O4 MolecularWeight: 295.29448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=CC(=N2)N)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=CC(=N2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N5O4/c1-2-21-12(18)16-7-5-15(6-8-16)11-9(17(19)20)3-4-10(13)14-11/h3-4H,2,5-8H2,1H3,(H2,13,14)