dimethyl 2-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]propanedioate

Systemtic Name: dimethyl 2-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]propanedioate Openeye Name: dimethyl 2-[2-(3-nitrophenyl)-2-oxo-ethyl]propanedioate CAS Name: 2-[2-(3-nitrophenyl)-2-oxoethyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-(3-nitrophenyl)-2-oxoethyl]propanedioate Traditional Name: 2-[2-keto-2-(3-nitrophenyl)ethyl]malonic acid dimethyl ester Formula: C13H13NO7 MolecularWeight: 295.24482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C(CC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H13NO7/c1-20-12(16)10(13(17)21-2)7-11(15)8-4-3-5-9(6-8)14(18)19/h3-6,10H,7H2,1-2H3