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

Systemtic Name: 3-[[4,4-bis[(2-fluoranylphenoxy)methyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[4,4-bis[(2-fluorophenoxy)methyl]-1-piperidyl]methyl]-1H-pyrazin-2-one CAS Name: 3-[[4,4-bis[(2-fluorophenoxy)methyl]-1-piperidinyl]methyl]-1H-pyrazin-2-one IUPAC Name: 3-[[4,4-bis[(2-fluorophenoxy)methyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Traditional Name: 3-[[4,4-bis[(2-fluorophenoxy)methyl]piperidino]methyl]-1H-pyrazin-2-one Formula: C24H25F2N3O3 MolecularWeight: 441.470406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(COC2=CC=CC=C2F)COC3=CC=CC=C3F)CC4=NC=CNC4=O

Isomeric SMILES

C1CN(CCC1(COC2=CC=CC=C2F)COC3=CC=CC=C3F)CC4=NC=CNC4=O

InChI

InChI=1S/C24H25F2N3O3/c25-18-5-1-3-7-21(18)31-16-24(17-32-22-8-4-2-6-19(22)26)9-13-29(14-10-24)15-20-23(30)28-12-11-27-20/h1-8,11-12H,9-10,13-17H2,(H,28,30)