[(3S,7S)-3,7,11-trimethyldodeca-1,10-dien-3-yl] benzenesulfonate

Systemtic Name: [(3S,7S)-3,7,11-trimethyldodeca-1,10-dien-3-yl] benzenesulfonate Openeye Name: [(1S,5S)-1,5,9-trimethyl-1-vinyl-dec-8-enyl] benzenesulfonate CAS Name: benzenesulfonic acid [(3S,7S)-3,7,11-trimethyldodeca-1,10-dien-3-yl] ester IUPAC Name: [(3S,7S)-3,7,11-trimethyldodeca-1,10-dien-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [(1S,5S)-1,5,9-trimethyl-1-vinyl-dec-8-enyl] ester Formula: C21H32O3S MolecularWeight: 364.54198

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C=C)OS(=O)(=O)C1=CC=CC=C1)CCC=C(C)C

Isomeric SMILES

C[C@@H](CCC[C@@](C)(C=C)OS(=O)(=O)C1=CC=CC=C1)CCC=C(C)C

InChI

InChI=1S/C21H32O3S/c1-6-21(5,17-11-14-19(4)13-10-12-18(2)3)24-25(22,23)20-15-8-7-9-16-20/h6-9,12,15-16,19H,1,10-11,13-14,17H2,2-5H3/t19-,21-/m1/s1