[2-(4-methoxyphenyl)-2-(oxan-2-yloxy)ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(4-methoxyphenyl)-2-(oxan-2-yloxy)ethyl] 4-methylbenzenesulfonate Openeye Name: [2-(4-methoxyphenyl)-2-tetrahydropyran-2-yloxy-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(4-methoxyphenyl)-2-(2-oxanyloxy)ethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-(oxan-2-yloxy)ethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(4-methoxyphenyl)-2-tetrahydropyran-2-yloxy-ethyl] ester Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC=C(C=C2)OC)OC3CCCCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC=C(C=C2)OC)OC3CCCCO3

InChI

InChI=1S/C21H26O6S/c1-16-6-12-19(13-7-16)28(22,23)26-15-20(27-21-5-3-4-14-25-21)17-8-10-18(24-2)11-9-17/h6-13,20-21H,3-5,14-15H2,1-2H3