1-(4-methoxybutyl)-3-[8-(oxan-2-yloxy)-2-oxidanyl-oct-3-ynyl]-3-phenylsulfanyl-piperidin-2-one

Systemtic Name: 1-(4-methoxybutyl)-3-[8-(oxan-2-yloxy)-2-oxidanyl-oct-3-ynyl]-3-phenylsulfanyl-piperidin-2-one Openeye Name: 3-(2-hydroxy-8-tetrahydropyran-2-yloxy-oct-3-ynyl)-1-(4-methoxybutyl)-3-phenylsulfanyl-piperidin-2-one CAS Name: 3-[2-hydroxy-8-(2-oxanyloxy)oct-3-ynyl]-1-(4-methoxybutyl)-3-(phenylthio)-2-piperidinone IUPAC Name: 3-[2-hydroxy-8-(oxan-2-yloxy)oct-3-ynyl]-1-(4-methoxybutyl)-3-phenylsulfanylpiperidin-2-one Traditional Name: 3-(2-hydroxy-8-tetrahydropyran-2-yloxy-oct-3-ynyl)-1-(4-methoxybutyl)-3-(phenylthio)-2-piperidone Formula: C29H43NO5S MolecularWeight: 517.72042

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCN1CCCC(C1=O)(CC(C#CCCCCOC2CCCCO2)O)SC3=CC=CC=C3

Isomeric SMILES

COCCCCN1CCCC(C1=O)(CC(C#CCCCCOC2CCCCO2)O)SC3=CC=CC=C3

InChI

InChI=1S/C29H43NO5S/c1-33-21-12-9-19-30-20-13-18-29(28(30)32,36-26-15-6-4-7-16-26)24-25(31)14-5-2-3-10-22-34-27-17-8-11-23-35-27/h4,6-7,15-16,25,27,31H,2-3,8-13,17-24H2,1H3