[(3R)-3,7-dimethyloctyl] 4-methylbenzenesulfonate

Systemtic Name: [(3R)-3,7-dimethyloctyl] 4-methylbenzenesulfonate Openeye Name: [(3R)-3,7-dimethyloctyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3R)-3,7-dimethyloctyl] ester IUPAC Name: [(3R)-3,7-dimethyloctyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3R)-3,7-dimethyloctyl] ester Formula: C17H28O3S MolecularWeight: 312.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC[C@H](C)CCCC(C)C

InChI

InChI=1S/C17H28O3S/c1-14(2)6-5-7-15(3)12-13-20-21(18,19)17-10-8-16(4)9-11-17/h8-11,14-15H,5-7,12-13H2,1-4H3/t15-/m1/s1