[(3R)-3-oxidanylnonyl] 4-methylbenzenesulfonate

Systemtic Name: [(3R)-3-oxidanylnonyl] 4-methylbenzenesulfonate Openeye Name: [(3R)-3-hydroxynonyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R)-3-hydroxynonyl] ester IUPAC Name: [(3R)-3-hydroxynonyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3R)-3-hydroxynonyl] ester Formula: C16H26O4S MolecularWeight: 314.44024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCOS(=O)(=O)C1=CC=C(C=C1)C)O

Isomeric SMILES

CCCCCC[C@H](CCOS(=O)(=O)C1=CC=C(C=C1)C)O

InChI

InChI=1S/C16H26O4S/c1-3-4-5-6-7-15(17)12-13-20-21(18,19)16-10-8-14(2)9-11-16/h8-11,15,17H,3-7,12-13H2,1-2H3/t15-/m1/s1