cyanomethyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: cyanomethyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: cyanomethyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid cyanomethyl ester Formula: C12H9N3O3 MolecularWeight: 243.21816

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC#N

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC#N

InChI

InChI=1S/C12H9N3O3/c1-15-11(16)9-5-3-2-4-8(9)10(14-15)12(17)18-7-6-13/h2-5H,7H2,1H3