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

Systemtic Name: [2-(2-methylphenyl)-2-(oxan-2-yloxy)ethyl] 4-methylbenzenesulfonate Openeye Name: [2-(o-tolyl)-2-tetrahydropyran-2-yloxy-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(2-methylphenyl)-2-(2-oxanyloxy)ethyl] ester IUPAC Name: [2-(2-methylphenyl)-2-(oxan-2-yloxy)ethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(o-tolyl)-2-tetrahydropyran-2-yloxy-ethyl] ester Formula: C21H26O5S MolecularWeight: 390.49314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC=CC=C2C)OC3CCCCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(C2=CC=CC=C2C)OC3CCCCO3

InChI

InChI=1S/C21H26O5S/c1-16-10-12-18(13-11-16)27(22,23)25-15-20(19-8-4-3-7-17(19)2)26-21-9-5-6-14-24-21/h3-4,7-8,10-13,20-21H,5-6,9,14-15H2,1-2H3