ethyl 2-(1-methyl-3-nitro-2-oxidanylidene-quinolin-4-yl)-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(1-methyl-3-nitro-2-oxidanylidene-quinolin-4-yl)-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(1-methyl-3-nitro-2-oxo-4-quinolyl)-3-oxo-butanoate CAS Name: 2-(1-methyl-3-nitro-2-oxo-4-quinolinyl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(1-methyl-3-nitro-2-oxoquinolin-4-yl)-3-oxobutanoate Traditional Name: 3-keto-2-(2-keto-1-methyl-3-nitro-4-quinolyl)butyric acid ethyl ester Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C(=O)N(C2=CC=CC=C21)C)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C(C1=C(C(=O)N(C2=CC=CC=C21)C)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C16H16N2O6/c1-4-24-16(21)12(9(2)19)13-10-7-5-6-8-11(10)17(3)15(20)14(13)18(22)23/h5-8,12H,4H2,1-3H3