(4E)-5-(3-methoxy-4-oxidanyl-phenyl)-1,1-bis(methylsulfanyl)penta-1,4-dien-3-one

Systemtic Name: (4E)-5-(3-methoxy-4-oxidanyl-phenyl)-1,1-bis(methylsulfanyl)penta-1,4-dien-3-one Openeye Name: (4E)-5-(4-hydroxy-3-methoxy-phenyl)-1,1-bis(methylsulfanyl)penta-1,4-dien-3-one CAS Name: (4E)-5-(4-hydroxy-3-methoxyphenyl)-1,1-bis(methylthio)-3-penta-1,4-dienone IUPAC Name: (4E)-5-(4-hydroxy-3-methoxyphenyl)-1,1-bis(methylsulfanyl)penta-1,4-dien-3-one Traditional Name: (4E)-5-(4-hydroxy-3-methoxy-phenyl)-1,1-bis(methylthio)penta-1,4-dien-3-one Formula: C14H16O3S2 MolecularWeight: 296.40504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C=C(SC)SC)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C=C(SC)SC)O

InChI

InChI=1S/C14H16O3S2/c1-17-13-8-10(5-7-12(13)16)4-6-11(15)9-14(18-2)19-3/h4-9,16H,1-3H3/b6-4+