4-[fluoranyl(phenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one

Systemtic Name: 4-[fluoranyl(phenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one Openeye Name: 4-[fluoro(phenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one CAS Name: 4-[fluoro(phenyl)methyl]-2-(1-methyl-4-azepanyl)-1-phthalazinone IUPAC Name: 4-[fluoro(phenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one Traditional Name: 4-[fluoro(phenyl)methyl]-2-(1-methylazepan-4-yl)phthalazin-1-one Formula: C22H24FN3O MolecularWeight: 365.443863

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)C(C4=CC=CC=C4)F

Isomeric SMILES

CN1CCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)C(C4=CC=CC=C4)F

InChI

InChI=1S/C22H24FN3O/c1-25-14-7-10-17(13-15-25)26-22(27)19-12-6-5-11-18(19)21(24-26)20(23)16-8-3-2-4-9-16/h2-6,8-9,11-12,17,20H,7,10,13-15H2,1H3