bis[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-[(3-nitrophenyl)methylidene]propanedioate

Systemtic Name: bis[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-[(3-nitrophenyl)methylidene]propanedioate Openeye Name: bis[2-(4-nitrophenyl)-2-oxo-ethyl] 2-[(3-nitrophenyl)methylene]propanedioate CAS Name: 2-[(3-nitrophenyl)methylidene]propanedioic acid bis[2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: bis[2-(4-nitrophenyl)-2-oxoethyl] 2-[(3-nitrophenyl)methylidene]propanedioate Traditional Name: 2-(3-nitrobenzylidene)malonic acid bis[2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C26H17N3O12 MolecularWeight: 563.42608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H17N3O12/c30-23(17-4-8-19(9-5-17)27(34)35)14-40-25(32)22(13-16-2-1-3-21(12-16)29(38)39)26(33)41-15-24(31)18-6-10-20(11-7-18)28(36)37/h1-13H,14-15H2