ethyl 1-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-3-phenyl-phthalazine-6-carboxylate

Systemtic Name: ethyl 1-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-3-phenyl-phthalazine-6-carboxylate Openeye Name: ethyl 1-(hydroxymethyl)-5,7-dimethyl-4-oxo-3-phenyl-phthalazine-6-carboxylate CAS Name: 1-(hydroxymethyl)-5,7-dimethyl-4-oxo-3-phenyl-6-phthalazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(hydroxymethyl)-5,7-dimethyl-4-oxo-3-phenylphthalazine-6-carboxylate Traditional Name: 4-keto-5,7-dimethyl-1-methylol-3-phenyl-phthalazine-6-carboxylic acid ethyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(=NN(C(=O)C2=C1C)C3=CC=CC=C3)CO)C

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(=NN(C(=O)C2=C1C)C3=CC=CC=C3)CO)C

InChI

InChI=1S/C20H20N2O4/c1-4-26-20(25)17-12(2)10-15-16(11-23)21-22(14-8-6-5-7-9-14)19(24)18(15)13(17)3/h5-10,23H,4,11H2,1-3H3