[4-(4-ethoxyphenyl)cyclohexyl] 2-methylbenzenesulfonate

Systemtic Name: [4-(4-ethoxyphenyl)cyclohexyl] 2-methylbenzenesulfonate Openeye Name: [4-(4-ethoxyphenyl)cyclohexyl] 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid [4-(4-ethoxyphenyl)cyclohexyl] ester IUPAC Name: [4-(4-ethoxyphenyl)cyclohexyl] 2-methylbenzenesulfonate Traditional Name: 2-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=CC=C3C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCC(CC2)OS(=O)(=O)C3=CC=CC=C3C

InChI

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