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(2S,3S)-3-hexadecylsulfanyl-2-(phenylmethoxymethyl)oxane

(2S,3S)-3-hexadecylsulfanyl-2-(phenylmethoxymethyl)oxane

Systemtic Name:(2S,3S)-3-hexadecylsulfanyl-2-(phenylmethoxymethyl)oxane
Openeye Name:(2S,3S)-2-(benzyloxymethyl)-3-hexadecylsulfanyl-tetrahydropyran
CAS Name:(2S,3S)-3-(hexadecylthio)-2-(phenylmethoxymethyl)oxane
IUPAC Name:(2S,3S)-3-hexadecylsulfanyl-2-(phenylmethoxymethyl)oxane
Traditional Name:(2S,3S)-2-(benzoxymethyl)-3-(cetylthio)tetrahydropyran
Formula: C29H50O2S
MolecularWeight: 462.7711
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1CCCOC1COCC2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCCCCCCS[C@H]1CCCO[C@H]1COCC2=CC=CC=C2


InChI

InChI=1S/C29H50O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-24-32-29-22-19-23-31-28(29)26-30-25-27-20-16-15-17-21-27/h15-17,20-21,28-29H,2-14,18-19,22-26H2,1H3/t28-,29-/m0/s1


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