4-[1-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]piperidin-4-yl]-2H-phthalazin-1-one

Systemtic Name: 4-[1-[3-(4-fluoranylphenoxy)-2-oxidanyl-propyl]piperidin-4-yl]-2H-phthalazin-1-one Openeye Name: 4-[1-[3-(4-fluorophenoxy)-2-hydroxy-propyl]-4-piperidyl]-2H-phthalazin-1-one CAS Name: 4-[1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-4-piperidinyl]-2H-phthalazin-1-one IUPAC Name: 4-[1-[3-(4-fluorophenoxy)-2-hydroxypropyl]piperidin-4-yl]-2H-phthalazin-1-one Traditional Name: 4-[1-[3-(4-fluorophenoxy)-2-hydroxy-propyl]-4-piperidyl]-2H-phthalazin-1-one Formula: C22H24FN3O3 MolecularWeight: 397.442663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NNC(=O)C3=CC=CC=C32)CC(COC4=CC=C(C=C4)F)O

Isomeric SMILES

C1CN(CCC1C2=NNC(=O)C3=CC=CC=C32)CC(COC4=CC=C(C=C4)F)O

InChI

InChI=1S/C22H24FN3O3/c23-16-5-7-18(8-6-16)29-14-17(27)13-26-11-9-15(10-12-26)21-19-3-1-2-4-20(19)22(28)25-24-21/h1-8,15,17,27H,9-14H2,(H,25,28)