3-[[4-[2-(2-fluorophenyl)-2-oxidanyl-ethyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one

Systemtic Name: 3-[[4-[2-(2-fluorophenyl)-2-oxidanyl-ethyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[4-[2-(2-fluorophenyl)-2-hydroxy-ethyl]-1-piperidyl]methyl]-1H-pyrazin-2-one CAS Name: 3-[[4-[2-(2-fluorophenyl)-2-hydroxyethyl]-1-piperidinyl]methyl]-1H-pyrazin-2-one IUPAC Name: 3-[[4-[2-(2-fluorophenyl)-2-hydroxyethyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Traditional Name: 3-[[4-[2-(2-fluorophenyl)-2-hydroxy-ethyl]piperidino]methyl]-1H-pyrazin-2-one Formula: C18H22FN3O2 MolecularWeight: 331.384583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(C2=CC=CC=C2F)O)CC3=NC=CNC3=O

Isomeric SMILES

C1CN(CCC1CC(C2=CC=CC=C2F)O)CC3=NC=CNC3=O

InChI

InChI=1S/C18H22FN3O2/c19-15-4-2-1-3-14(15)17(23)11-13-5-9-22(10-6-13)12-16-18(24)21-8-7-20-16/h1-4,7-8,13,17,23H,5-6,9-12H2,(H,21,24)