(4-cyano-2-ethoxy-phenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-cyano-2-ethoxy-phenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-cyano-2-ethoxy-phenyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (4-cyano-2-ethoxyphenyl) ester IUPAC Name: (4-cyano-2-ethoxyphenyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (4-cyano-2-ethoxy-phenyl) ester Formula: C19H15N3O4 MolecularWeight: 349.3401

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H15N3O4/c1-3-25-16-10-12(11-20)8-9-15(16)26-19(24)17-13-6-4-5-7-14(13)18(23)22(2)21-17/h4-10H,3H2,1-2H3