[(E)-hept-3-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-hept-3-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-hept-3-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-hept-3-enyl] ester IUPAC Name: [(E)-hept-3-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-hept-3-enyl] ester Formula: C14H20O3S MolecularWeight: 268.3718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O3S/c1-3-4-5-6-7-12-17-18(15,16)14-10-8-13(2)9-11-14/h5-6,8-11H,3-4,7,12H2,1-2H3/b6-5+