6,6-dimethyl-3-methylsulfanyl-1-[(E)-3-oxidanylprop-2-enoyl]-5,7-dihydro-2-benzothiophen-4-one

Systemtic Name: 6,6-dimethyl-3-methylsulfanyl-1-[(E)-3-oxidanylprop-2-enoyl]-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 1-[(E)-3-hydroxyprop-2-enoyl]-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-one CAS Name: 1-[(E)-3-hydroxy-1-oxoprop-2-enyl]-6,6-dimethyl-3-(methylthio)-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 1-[(E)-3-hydroxyprop-2-enoyl]-6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 1-[(E)-3-hydroxyacryloyl]-6,6-dimethyl-3-(methylthio)-5,7-dihydroisobenzothiophen-4-one Formula: C14H16O3S2 MolecularWeight: 296.40504

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(SC(=C2C(=O)C1)SC)C(=O)C=CO)C

Isomeric SMILES

CC1(CC2=C(SC(=C2C(=O)C1)SC)C(=O)/C=C/O)C

InChI

InChI=1S/C14H16O3S2/c1-14(2)6-8-11(10(17)7-14)13(18-3)19-12(8)9(16)4-5-15/h4-5,15H,6-7H2,1-3H3/b5-4+