diethyl 2-[2-[methyl-(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]propanedioate

Systemtic Name: diethyl 2-[2-[methyl-(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]propanedioate Openeye Name: diethyl 2-[2-(N-methyl-4-nitro-anilino)-2-oxo-ethyl]propanedioate CAS Name: 2-[2-(N-methyl-4-nitroanilino)-2-oxoethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-(N-methyl-4-nitroanilino)-2-oxoethyl]propanedioate Traditional Name: 2-[2-keto-2-(N-methyl-4-nitro-anilino)ethyl]malonic acid diethyl ester Formula: C16H20N2O7 MolecularWeight: 352.3392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O7/c1-4-24-15(20)13(16(21)25-5-2)10-14(19)17(3)11-6-8-12(9-7-11)18(22)23/h6-9,13H,4-5,10H2,1-3H3