[(3E,6E)-nona-3,6-dienyl] 4-methylbenzenesulfonate

Systemtic Name: [(3E,6E)-nona-3,6-dienyl] 4-methylbenzenesulfonate Openeye Name: [(3E,6E)-nona-3,6-dienyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3E,6E)-nona-3,6-dienyl] ester IUPAC Name: [(3E,6E)-nona-3,6-dienyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3E,6E)-nona-3,6-dienyl] ester Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCCOS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3S/c1-3-4-5-6-7-8-9-14-19-20(17,18)16-12-10-15(2)11-13-16/h4-5,7-8,10-13H,3,6,9,14H2,1-2H3/b5-4+,8-7+