[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 4-(3,4-dicyanophenoxy)benzoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 4-(3,4-dicyanophenoxy)benzoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 4-(3,4-dicyanophenoxy)benzoate CAS Name: 4-(3,4-dicyanophenoxy)benzoic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 4-(3,4-dicyanophenoxy)benzoate Traditional Name: 4-(3,4-dicyanophenoxy)benzoic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C23H13N3O6 MolecularWeight: 427.36582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)COC(=O)C2=CC=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)COC(=O)C2=CC=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C23H13N3O6/c24-12-17-5-10-21(11-18(17)13-25)32-20-8-3-16(4-9-20)23(28)31-14-22(27)15-1-6-19(7-2-15)26(29)30/h1-11H,14H2