(2E,4E)-5-(phenylmethylsulfanyl)penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-5-(phenylmethylsulfanyl)penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-benzylsulfanylpenta-2,4-dienoic acid CAS Name: (2E,4E)-5-(phenylmethylthio)penta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-benzylsulfanylpenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-(benzylthio)penta-2,4-dienoic acid Formula: C12H12O2S MolecularWeight: 220.28748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC=CC=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H12O2S/c13-12(14)8-4-5-9-15-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,13,14)/b8-4+,9-5+