methyl 6-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 6-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 6-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-4-methylsulfanyl-2-oxo-pyran-3-carboxylate CAS Name: 6-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-(methylthio)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-4-methylsulfanyl-2-oxopyran-3-carboxylate Traditional Name: 6-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-2-keto-4-(methylthio)pyran-3-carboxylic acid methyl ester Formula: C17H14O6S MolecularWeight: 346.35446

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(OC1=O)C=CC2=CC3=C(C=C2)OCO3)SC

Isomeric SMILES

COC(=O)C1=C(C=C(OC1=O)/C=C/C2=CC3=C(C=C2)OCO3)SC

InChI

InChI=1S/C17H14O6S/c1-20-16(18)15-14(24-2)8-11(23-17(15)19)5-3-10-4-6-12-13(7-10)22-9-21-12/h3-8H,9H2,1-2H3/b5-3+