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8-[8-(oxan-2-yloxy)octoxy]octyl 4-methylbenzenesulfonate

8-[8-(oxan-2-yloxy)octoxy]octyl 4-methylbenzenesulfonate

Systemtic Name:8-[8-(oxan-2-yloxy)octoxy]octyl 4-methylbenzenesulfonate
Openeye Name:8-(8-tetrahydropyran-2-yloxyoctoxy)octyl 4-methylbenzenesulfonate
CAS Name:4-methylbenzenesulfonic acid 8-[8-(2-oxanyloxy)octoxy]octyl ester
IUPAC Name:8-[8-(oxan-2-yloxy)octoxy]octyl 4-methylbenzenesulfonate
Traditional Name:4-methylbenzenesulfonic acid 8-(8-tetrahydropyran-2-yloxyoctoxy)octyl ester
Formula: C28H48O6S
MolecularWeight: 512.74212
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCOCCCCCCCCOC2CCCCO2


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCOCCCCCCCCOC2CCCCO2


InChI

InChI=1S/C28H48O6S/c1-26-17-19-27(20-18-26)35(29,30)34-25-14-9-5-3-7-12-22-31-21-11-6-2-4-8-13-23-32-28-16-10-15-24-33-28/h17-20,28H,2-16,21-25H2,1H3


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