[2-(hydroxymethyl)-3,5-dimethyl-6-phenylsulfanyl-oxan-4-yl] 4-oxidanylpentanoate

Systemtic Name: [2-(hydroxymethyl)-3,5-dimethyl-6-phenylsulfanyl-oxan-4-yl] 4-oxidanylpentanoate Openeye Name: [2-(hydroxymethyl)-3,5-dimethyl-6-phenylsulfanyl-tetrahydropyran-4-yl] 4-hydroxypentanoate CAS Name: 4-hydroxypentanoic acid [2-(hydroxymethyl)-3,5-dimethyl-6-(phenylthio)-4-oxanyl] ester IUPAC Name: [2-(hydroxymethyl)-3,5-dimethyl-6-phenylsulfanyloxan-4-yl] 4-hydroxypentanoate Traditional Name: 4-hydroxyvaleric acid [3,5-dimethyl-2-methylol-6-(phenylthio)tetrahydropyran-4-yl] ester Formula: C19H28O5S MolecularWeight: 368.48762

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(C(C1OC(=O)CCC(C)O)C)SC2=CC=CC=C2)CO

Isomeric SMILES

CC1C(OC(C(C1OC(=O)CCC(C)O)C)SC2=CC=CC=C2)CO

InChI

InChI=1S/C19H28O5S/c1-12(21)9-10-17(22)24-18-13(2)16(11-20)23-19(14(18)3)25-15-7-5-4-6-8-15/h4-8,12-14,16,18-21H,9-11H2,1-3H3