methyl 6-[(E)-2-(4-methoxyphenyl)ethenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 6-[(E)-2-(4-methoxyphenyl)ethenyl]-4-methylsulfanyl-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 6-[(E)-2-(4-methoxyphenyl)vinyl]-4-methylsulfanyl-2-oxo-pyran-3-carboxylate CAS Name: 6-[(E)-2-(4-methoxyphenyl)ethenyl]-4-(methylthio)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-[(E)-2-(4-methoxyphenyl)ethenyl]-4-methylsulfanyl-2-oxopyran-3-carboxylate Traditional Name: 2-keto-6-[(E)-2-(4-methoxyphenyl)vinyl]-4-(methylthio)pyran-3-carboxylic acid methyl ester Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=CC(=C(C(=O)O2)C(=O)OC)SC

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=CC(=C(C(=O)O2)C(=O)OC)SC

InChI

InChI=1S/C17H16O5S/c1-20-12-7-4-11(5-8-12)6-9-13-10-14(23-3)15(16(18)21-2)17(19)22-13/h4-10H,1-3H3/b9-6+