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

Systemtic Name: diethyl 2-(3-nitro-2-oxidanylidene-1-phenyl-quinolin-4-yl)propanedioate Openeye Name: diethyl 2-(3-nitro-2-oxo-1-phenyl-4-quinolyl)propanedioate CAS Name: 2-(3-nitro-2-oxo-1-phenyl-4-quinolinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-nitro-2-oxo-1-phenylquinolin-4-yl)propanedioate Traditional Name: 2-(2-keto-3-nitro-1-phenyl-4-quinolyl)malonic acid diethyl ester Formula: C22H20N2O7 MolecularWeight: 424.4034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C(=O)N(C2=CC=CC=C21)C3=CC=CC=C3)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(C(=O)N(C2=CC=CC=C21)C3=CC=CC=C3)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C22H20N2O7/c1-3-30-21(26)18(22(27)31-4-2)17-15-12-8-9-13-16(15)23(14-10-6-5-7-11-14)20(25)19(17)24(28)29/h5-13,18H,3-4H2,1-2H3