dimethyl 2-[2-nitro-1-(3-nitrophenyl)-2-phenyl-ethyl]propanedioate

Systemtic Name: dimethyl 2-[2-nitro-1-(3-nitrophenyl)-2-phenyl-ethyl]propanedioate Openeye Name: dimethyl 2-[2-nitro-1-(3-nitrophenyl)-2-phenyl-ethyl]propanedioate CAS Name: 2-[2-nitro-1-(3-nitrophenyl)-2-phenylethyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-nitro-1-(3-nitrophenyl)-2-phenylethyl]propanedioate Traditional Name: 2-[2-nitro-1-(3-nitrophenyl)-2-phenyl-ethyl]malonic acid dimethyl ester Formula: C19H18N2O8 MolecularWeight: 402.35482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC(=CC=C1)[N+](=O)[O-])C(C2=CC=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC(=O)C(C(C1=CC(=CC=C1)[N+](=O)[O-])C(C2=CC=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H18N2O8/c1-28-18(22)16(19(23)29-2)15(13-9-6-10-14(11-13)20(24)25)17(21(26)27)12-7-4-3-5-8-12/h3-11,15-17H,1-2H3