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

Systemtic Name: 3-[[4-[(2-fluoranylphenoxy)methyl]-4-oxidanyl-piperidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[4-[(2-fluorophenoxy)methyl]-4-hydroxy-1-piperidyl]methyl]-1H-pyrazin-2-one CAS Name: 3-[[4-[(2-fluorophenoxy)methyl]-4-hydroxy-1-piperidinyl]methyl]-1H-pyrazin-2-one IUPAC Name: 3-[[4-[(2-fluorophenoxy)methyl]-4-hydroxypiperidin-1-yl]methyl]-1H-pyrazin-2-one Traditional Name: 3-[[4-[(2-fluorophenoxy)methyl]-4-hydroxy-piperidino]methyl]-1H-pyrazin-2-one Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(COC2=CC=CC=C2F)O)CC3=NC=CNC3=O

Isomeric SMILES

C1CN(CCC1(COC2=CC=CC=C2F)O)CC3=NC=CNC3=O

InChI

InChI=1S/C17H20FN3O3/c18-13-3-1-2-4-15(13)24-12-17(23)5-9-21(10-6-17)11-14-16(22)20-8-7-19-14/h1-4,7-8,23H,5-6,9-12H2,(H,20,22)