(4-ethanoylphenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-ethanoylphenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-acetylphenyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (4-acetylphenyl) ester Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C18H14N2O4/c1-11(21)12-7-9-13(10-8-12)24-18(23)16-14-5-3-4-6-15(14)17(22)20(2)19-16/h3-10H,1-2H3