[4-(2-butylphenyl)-1-oxidanyl-cyclohexyl] ethanesulfonate

Systemtic Name: [4-(2-butylphenyl)-1-oxidanyl-cyclohexyl] ethanesulfonate Openeye Name: [4-(2-butylphenyl)-1-hydroxy-cyclohexyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-(2-butylphenyl)-1-hydroxycyclohexyl] ester IUPAC Name: [4-(2-butylphenyl)-1-hydroxycyclohexyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-(2-butylphenyl)-1-hydroxy-cyclohexyl] ester Formula: C18H28O4S MolecularWeight: 340.47752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1C2CCC(CC2)(O)OS(=O)(=O)CC

Isomeric SMILES

CCCCC1=CC=CC=C1C2CCC(CC2)(O)OS(=O)(=O)CC

InChI

InChI=1S/C18H28O4S/c1-3-5-8-15-9-6-7-10-17(15)16-11-13-18(19,14-12-16)22-23(20,21)4-2/h6-7,9-10,16,19H,3-5,8,11-14H2,1-2H3