ethyl 3-(2-chlorophenyl)-1-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-phthalazine-6-carboxylate

Systemtic Name: ethyl 3-(2-chlorophenyl)-1-(hydroxymethyl)-5,7-dimethyl-4-oxidanylidene-phthalazine-6-carboxylate Openeye Name: ethyl 3-(2-chlorophenyl)-1-(hydroxymethyl)-5,7-dimethyl-4-oxo-phthalazine-6-carboxylate CAS Name: 3-(2-chlorophenyl)-1-(hydroxymethyl)-5,7-dimethyl-4-oxo-6-phthalazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-chlorophenyl)-1-(hydroxymethyl)-5,7-dimethyl-4-oxophthalazine-6-carboxylate Traditional Name: 3-(2-chlorophenyl)-4-keto-5,7-dimethyl-1-methylol-phthalazine-6-carboxylic acid ethyl ester Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(=NN(C(=O)C2=C1C)C3=CC=CC=C3Cl)CO)C

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(=NN(C(=O)C2=C1C)C3=CC=CC=C3Cl)CO)C

InChI

InChI=1S/C20H19ClN2O4/c1-4-27-20(26)17-11(2)9-13-15(10-24)22-23(19(25)18(13)12(17)3)16-8-6-5-7-14(16)21/h5-9,24H,4,10H2,1-3H3