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

Systemtic Name: bis[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2-[(3-nitrophenyl)methylidene]propanedioate Openeye Name: bis[2-(3-nitrophenyl)-2-oxo-ethyl] 2-[(3-nitrophenyl)methylene]propanedioate CAS Name: 2-[(3-nitrophenyl)methylidene]propanedioic acid bis[2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: bis[2-(3-nitrophenyl)-2-oxoethyl] 2-[(3-nitrophenyl)methylidene]propanedioate Traditional Name: 2-(3-nitrobenzylidene)malonic acid bis[2-keto-2-(3-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(=CC=C2)[N+](=O)[O-])C(=O)OCC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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