[4-(3-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(3-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate Openeye Name: [4-(3-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(3-ethoxyphenyl)cyclohexyl] ester IUPAC Name: [4-(3-ethoxyphenyl)cyclohexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-m-phenetylcyclohexyl) ester Formula: C21H26O4S MolecularWeight: 374.49374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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