2-(2-oxidanylidenepropyl)-4-pyridin-3-yl-phthalazin-1-one

Systemtic Name: 2-(2-oxidanylidenepropyl)-4-pyridin-3-yl-phthalazin-1-one Openeye Name: 2-acetonyl-4-(3-pyridyl)phthalazin-1-one CAS Name: 2-(2-oxopropyl)-4-(3-pyridinyl)-1-phthalazinone IUPAC Name: 2-(2-oxopropyl)-4-pyridin-3-ylphthalazin-1-one Traditional Name: 2-acetonyl-4-(3-pyridyl)phthalazin-1-one Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O2/c1-11(20)10-19-16(21)14-7-3-2-6-13(14)15(18-19)12-5-4-8-17-9-12/h2-9H,10H2,1H3