[4-(4-chlorophenyl)carbonylphenyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [4-(4-chlorophenyl)carbonylphenyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [4-(4-chlorobenzoyl)phenyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [4-[(4-chlorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-chlorobenzoyl)phenyl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [4-(4-chlorobenzoyl)phenyl] ester Formula: C22H13ClN2O4 MolecularWeight: 404.80262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H13ClN2O4/c23-15-9-5-13(6-10-15)20(26)14-7-11-16(12-8-14)29-22(28)19-17-3-1-2-4-18(17)21(27)25-24-19/h1-12H,(H,25,27)