diethyl 2-(1-methyl-3-nitro-2-oxidanylidene-quinolin-4-yl)propanedioate

Systemtic Name: diethyl 2-(1-methyl-3-nitro-2-oxidanylidene-quinolin-4-yl)propanedioate Openeye Name: diethyl 2-(1-methyl-3-nitro-2-oxo-4-quinolyl)propanedioate CAS Name: 2-(1-methyl-3-nitro-2-oxo-4-quinolinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1-methyl-3-nitro-2-oxoquinolin-4-yl)propanedioate Traditional Name: 2-(2-keto-1-methyl-3-nitro-4-quinolyl)malonic acid diethyl ester Formula: C17H18N2O7 MolecularWeight: 362.33402

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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)OCC

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O7/c1-4-25-16(21)13(17(22)26-5-2)12-10-8-6-7-9-11(10)18(3)15(20)14(12)19(23)24/h6-9,13H,4-5H2,1-3H3