[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 6-(diphenylcarbamoyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 6-(diphenylcarbamoyl)cyclohex-3-ene-1-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 6-(diphenylcarbamoyl)cyclohex-3-ene-1-carboxylate CAS Name: 6-[oxo-(N-phenylanilino)methyl]-1-cyclohex-3-enecarboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 6-(diphenylcarbamoyl)cyclohex-3-ene-1-carboxylate Traditional Name: 6-(diphenylcarbamoyl)cyclohex-3-ene-1-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C28H24N2O6 MolecularWeight: 484.49996

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C=CCC(C1C(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H24N2O6/c31-26(20-10-9-15-23(18-20)30(34)35)19-36-28(33)25-17-8-7-16-24(25)27(32)29(21-11-3-1-4-12-21)22-13-5-2-6-14-22/h1-15,18,24-25H,16-17,19H2