pyridin-3-ylmethyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: pyridin-3-ylmethyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-pyridylmethyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid 3-pyridinylmethyl ester IUPAC Name: pyridin-3-ylmethyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid 3-pyridylmethyl ester Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CN=CC=C3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CN=CC=C3

InChI

InChI=1S/C16H13N3O3/c1-19-15(20)13-7-3-2-6-12(13)14(18-19)16(21)22-10-11-5-4-8-17-9-11/h2-9H,10H2,1H3