3-methyl-1-[4-[2-(2-methylphenyl)ethynyl]-4-oxidanyl-piperidin-1-yl]pyrazin-2-one

Systemtic Name: 3-methyl-1-[4-[2-(2-methylphenyl)ethynyl]-4-oxidanyl-piperidin-1-yl]pyrazin-2-one Openeye Name: 1-[4-hydroxy-4-[2-(o-tolyl)ethynyl]-1-piperidyl]-3-methyl-pyrazin-2-one CAS Name: 1-[4-hydroxy-4-[2-(2-methylphenyl)ethynyl]-1-piperidinyl]-3-methyl-2-pyrazinone IUPAC Name: 1-[4-hydroxy-4-[2-(2-methylphenyl)ethynyl]piperidin-1-yl]-3-methylpyrazin-2-one Traditional Name: 1-[4-hydroxy-4-[2-(o-tolyl)ethynyl]piperidino]-3-methyl-pyrazin-2-one Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C#CC2(CCN(CC2)N3C=CN=C(C3=O)C)O

Isomeric SMILES

CC1=CC=CC=C1C#CC2(CCN(CC2)N3C=CN=C(C3=O)C)O

InChI

InChI=1S/C19H21N3O2/c1-15-5-3-4-6-17(15)7-8-19(24)9-12-21(13-10-19)22-14-11-20-16(2)18(22)23/h3-6,11,14,24H,9-10,12-13H2,1-2H3