[4-(4-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(4-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate Openeye Name: [4-(4-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(4-ethoxyphenyl)cyclohexyl] ester IUPAC Name: [4-(4-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-p-phenetylcyclohexyl) ester Formula: C21H26O4S MolecularWeight: 374.49374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCC(CC2)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCC(CC2)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H26O4S/c1-3-24-19-10-6-17(7-11-19)18-8-12-20(13-9-18)25-26(22,23)21-14-4-16(2)5-15-21/h4-7,10-11,14-15,18,20H,3,8-9,12-13H2,1-2H3