(2-chloranyl-4-cyano-phenyl) 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-chloro-4-cyano-phenyl) 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid (2-chloro-4-cyano-phenyl) ester Formula: C18H12ClN3O3 MolecularWeight: 353.75918

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H12ClN3O3/c1-2-22-17(23)13-6-4-3-5-12(13)16(21-22)18(24)25-15-8-7-11(10-20)9-14(15)19/h3-9H,2H2,1H3