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

Systemtic Name: 3-[[4-[(2-methylphenoxy)methyl]-4-oxidanyl-piperidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[4-hydroxy-4-[(2-methylphenoxy)methyl]-1-piperidyl]methyl]-1H-pyrazin-2-one CAS Name: 3-[[4-hydroxy-4-[(2-methylphenoxy)methyl]-1-piperidinyl]methyl]-1H-pyrazin-2-one IUPAC Name: 3-[[4-hydroxy-4-[(2-methylphenoxy)methyl]piperidin-1-yl]methyl]-1H-pyrazin-2-one Traditional Name: 3-[[4-hydroxy-4-[(2-methylphenoxy)methyl]piperidino]methyl]-1H-pyrazin-2-one Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2(CCN(CC2)CC3=NC=CNC3=O)O

Isomeric SMILES

CC1=CC=CC=C1OCC2(CCN(CC2)CC3=NC=CNC3=O)O

InChI

InChI=1S/C18H23N3O3/c1-14-4-2-3-5-16(14)24-13-18(23)6-10-21(11-7-18)12-15-17(22)20-9-8-19-15/h2-5,8-9,23H,6-7,10-13H2,1H3,(H,20,22)