butyl 4,6-dimethyl-5-nitro-2-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: butyl 4,6-dimethyl-5-nitro-2-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: butyl 4,6-dimethyl-5-nitro-2-oxo-1H-pyridine-3-carboxylate CAS Name: 4,6-dimethyl-5-nitro-2-oxo-1H-pyridine-3-carboxylic acid butyl ester IUPAC Name: butyl 4,6-dimethyl-5-nitro-2-oxo-1H-pyridine-3-carboxylate Traditional Name: 2-keto-4,6-dimethyl-5-nitro-1H-pyridine-3-carboxylic acid butyl ester Formula: C12H16N2O5 MolecularWeight: 268.26584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C(=C(NC1=O)C)[N+](=O)[O-])C

Isomeric SMILES

CCCCOC(=O)C1=C(C(=C(NC1=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C12H16N2O5/c1-4-5-6-19-12(16)9-7(2)10(14(17)18)8(3)13-11(9)15/h4-6H2,1-3H3,(H,13,15)