ethyl 3-(4-acetamidophenyl)-5,7-dimethyl-4-oxidanylidene-phthalazine-6-carboxylate

Systemtic Name: ethyl 3-(4-acetamidophenyl)-5,7-dimethyl-4-oxidanylidene-phthalazine-6-carboxylate Openeye Name: ethyl 3-(4-acetamidophenyl)-5,7-dimethyl-4-oxo-phthalazine-6-carboxylate CAS Name: 3-(4-acetamidophenyl)-5,7-dimethyl-4-oxo-6-phthalazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-acetamidophenyl)-5,7-dimethyl-4-oxophthalazine-6-carboxylate Traditional Name: 3-(4-acetamidophenyl)-4-keto-5,7-dimethyl-phthalazine-6-carboxylic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-5-28-21(27)18-12(2)10-15-11-22-24(20(26)19(15)13(18)3)17-8-6-16(7-9-17)23-14(4)25/h6-11H,5H2,1-4H3,(H,23,25)