[(2E)-4-(6-oxidanylhexylsulfanyl)penta-2,4-dienyl] benzoate

Systemtic Name: [(2E)-4-(6-oxidanylhexylsulfanyl)penta-2,4-dienyl] benzoate Openeye Name: [(2E)-4-(6-hydroxyhexylsulfanyl)penta-2,4-dienyl] benzoate CAS Name: benzoic acid [(2E)-4-(6-hydroxyhexylthio)penta-2,4-dienyl] ester IUPAC Name: [(2E)-4-(6-hydroxyhexylsulfanyl)penta-2,4-dienyl] benzoate Traditional Name: benzoic acid [(2E)-4-(6-hydroxyhexylthio)penta-2,4-dienyl] ester Formula: C18H24O3S MolecularWeight: 320.44636

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C=CCOC(=O)C1=CC=CC=C1)SCCCCCCO

Isomeric SMILES

C=C(/C=C/COC(=O)C1=CC=CC=C1)SCCCCCCO

InChI

InChI=1S/C18H24O3S/c1-16(22-15-8-3-2-7-13-19)10-9-14-21-18(20)17-11-5-4-6-12-17/h4-6,9-12,19H,1-3,7-8,13-15H2/b10-9+