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

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 4-oxidanylidene-3-phenyl-phthalazine-1-carboxylate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl 4-oxo-3-phenyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-phenyl-1-phthalazinecarboxylic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl 4-oxo-3-phenylphthalazine-1-carboxylate Traditional Name: 4-keto-3-phenyl-phthalazine-1-carboxylic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C29H21N3O4 MolecularWeight: 475.49474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C29H21N3O4/c33-27(30-22-9-3-1-4-10-22)21-17-15-20(16-18-21)19-36-29(35)26-24-13-7-8-14-25(24)28(34)32(31-26)23-11-5-2-6-12-23/h1-18H,19H2,(H,30,33)