4-(2-pyridin-3-ylethyl)-2H-phthalazin-1-one

Systemtic Name: 4-(2-pyridin-3-ylethyl)-2H-phthalazin-1-one Openeye Name: 4-[2-(3-pyridyl)ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-(3-pyridinyl)ethyl]-2H-phthalazin-1-one IUPAC Name: 4-(2-pyridin-3-ylethyl)-2H-phthalazin-1-one Traditional Name: 4-[2-(3-pyridyl)ethyl]-2H-phthalazin-1-one Formula: C15H13N3O MolecularWeight: 251.28322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CCC3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CCC3=CN=CC=C3

InChI

InChI=1S/C15H13N3O/c19-15-13-6-2-1-5-12(13)14(17-18-15)8-7-11-4-3-9-16-10-11/h1-6,9-10H,7-8H2,(H,18,19)