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

Systemtic Name: [4-(cyanomethyl)phenyl] 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate Openeye Name: [4-(cyanomethyl)phenyl] 4-oxo-3-phenyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-phenyl-1-phthalazinecarboxylic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] 4-oxo-3-phenylphthalazine-1-carboxylate Traditional Name: 4-keto-3-phenyl-phthalazine-1-carboxylic acid [4-(cyanomethyl)phenyl] ester Formula: C23H15N3O3 MolecularWeight: 381.3835

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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)CC#N

Isomeric SMILES

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

InChI

InChI=1S/C23H15N3O3/c24-15-14-16-10-12-18(13-11-16)29-23(28)21-19-8-4-5-9-20(19)22(27)26(25-21)17-6-2-1-3-7-17/h1-13H,14H2