4-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)butanoyl chloride

Systemtic Name: 4-(1-oxidanylidene-4-pyridin-3-yl-phthalazin-2-yl)butanoyl chloride Openeye Name: 4-[1-oxo-4-(3-pyridyl)phthalazin-2-yl]butanoyl chloride CAS Name: 4-[1-oxo-4-(3-pyridinyl)-2-phthalazinyl]butanoyl chloride IUPAC Name: 4-(1-oxo-4-pyridin-3-ylphthalazin-2-yl)butanoyl chloride Traditional Name: 4-[1-keto-4-(3-pyridyl)phthalazin-2-yl]butyryl chloride Formula: C17H14ClN3O2 MolecularWeight: 327.76496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCCC(=O)Cl)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCCC(=O)Cl)C3=CN=CC=C3

InChI

InChI=1S/C17H14ClN3O2/c18-15(22)8-4-10-21-17(23)14-7-2-1-6-13(14)16(20-21)12-5-3-9-19-11-12/h1-3,5-7,9,11H,4,8,10H2