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

Systemtic Name: [(3R)-3-methyloctyl] 4-methylbenzenesulfonate Openeye Name: [(3R)-3-methyloctyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R)-3-methyloctyl] ester IUPAC Name: [(3R)-3-methyloctyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3R)-3-methyloctyl] ester Formula: C16H26O3S MolecularWeight: 298.44084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26O3S/c1-4-5-6-7-14(2)12-13-19-20(17,18)16-10-8-15(3)9-11-16/h8-11,14H,4-7,12-13H2,1-3H3/t14-/m1/s1