(6-chloranylpyridin-3-yl)methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C15H10ClN3O3 MolecularWeight: 315.7112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC3=CN=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C15H10ClN3O3/c16-12-6-5-9(7-17-12)8-22-15(21)13-10-3-1-2-4-11(10)14(20)19-18-13/h1-7H,8H2,(H,19,20)