[4-[(1E,3S)-3-oxidanylhexa-1,5-dienyl]phenyl] methanesulfonate

Systemtic Name: [4-[(1E,3S)-3-oxidanylhexa-1,5-dienyl]phenyl] methanesulfonate Openeye Name: [4-[(1E,3S)-3-hydroxyhexa-1,5-dienyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[(1E,3S)-3-hydroxyhexa-1,5-dienyl]phenyl] ester IUPAC Name: [4-[(1E,3S)-3-hydroxyhexa-1,5-dienyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(1E,3S)-3-hydroxyhexa-1,5-dienyl]phenyl] ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)C=CC(CC=C)O

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)/C=C/[C@H](CC=C)O

InChI

InChI=1S/C13H16O4S/c1-3-4-12(14)8-5-11-6-9-13(10-7-11)17-18(2,15)16/h3,5-10,12,14H,1,4H2,2H3/b8-5+/t12-/m0/s1