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

Systemtic Name: bis[2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-[(3-nitrophenyl)methylidene]propanedioate Openeye Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] 2-[(3-nitrophenyl)methylene]propanedioate CAS Name: 2-[(3-nitrophenyl)methylidene]propanedioic acid bis[2-oxo-2-(4-phenylphenyl)ethyl] ester IUPAC Name: bis[2-oxo-2-(4-phenylphenyl)ethyl] 2-[(3-nitrophenyl)methylidene]propanedioate Traditional Name: 2-(3-nitrobenzylidene)malonic acid bis[2-keto-2-(4-phenylphenyl)ethyl] ester Formula: C38H27NO8 MolecularWeight: 625.62288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)COC(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C38H27NO8/c40-35(31-18-14-29(15-19-31)27-9-3-1-4-10-27)24-46-37(42)34(23-26-8-7-13-33(22-26)39(44)45)38(43)47-25-36(41)32-20-16-30(17-21-32)28-11-5-2-6-12-28/h1-23H,24-25H2