(4-phenylphenyl)methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: (4-phenylphenyl)methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: (4-phenylphenyl)methyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid (4-phenylbenzyl) ester Formula: C22H16N2O3 MolecularWeight: 356.37404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)COC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)COC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H16N2O3/c25-21-19-9-5-4-8-18(19)20(23-24-21)22(26)27-14-15-10-12-17(13-11-15)16-6-2-1-3-7-16/h1-13H,14H2,(H,24,25)