(3,5-dimethylphenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (3,5-dimethylphenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (3,5-dimethylphenyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (3,5-dimethylphenyl) ester Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C

InChI

InChI=1S/C18H16N2O3/c1-11-8-12(2)10-13(9-11)23-18(22)16-14-6-4-5-7-15(14)17(21)20(3)19-16/h4-10H,1-3H3