[4-(4-cyanophenyl)phenyl] 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-oxo-3-phenyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-phenyl-1-phthalazinecarboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-oxo-3-phenylphthalazine-1-carboxylate Traditional Name: 4-keto-3-phenyl-phthalazine-1-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C28H17N3O3 MolecularWeight: 443.45288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C28H17N3O3/c29-18-19-10-12-20(13-11-19)21-14-16-23(17-15-21)34-28(33)26-24-8-4-5-9-25(24)27(32)31(30-26)22-6-2-1-3-7-22/h1-17H