ethyl 2-(5-ethoxy-6-nitro-pyridin-3-yl)-2-oxidanyl-butanoate

Systemtic Name: ethyl 2-(5-ethoxy-6-nitro-pyridin-3-yl)-2-oxidanyl-butanoate Openeye Name: ethyl 2-(5-ethoxy-6-nitro-3-pyridyl)-2-hydroxy-butanoate CAS Name: 2-(5-ethoxy-6-nitro-3-pyridinyl)-2-hydroxybutanoic acid ethyl ester IUPAC Name: ethyl 2-(5-ethoxy-6-nitropyridin-3-yl)-2-hydroxybutanoate Traditional Name: 2-(5-ethoxy-6-nitro-3-pyridyl)-2-hydroxy-butyric acid ethyl ester Formula: C13H18N2O6 MolecularWeight: 298.29182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(N=C1)[N+](=O)[O-])OCC)(C(=O)OCC)O

Isomeric SMILES

CCC(C1=CC(=C(N=C1)[N+](=O)[O-])OCC)(C(=O)OCC)O

InChI

InChI=1S/C13H18N2O6/c1-4-13(17,12(16)21-6-3)9-7-10(20-5-2)11(14-8-9)15(18)19/h7-8,17H,4-6H2,1-3H3