ethyl (3E,5Z)-6-(4-methylphenyl)-5-methylsulfanyl-6-oxidanyl-2-oxidanylidene-hexa-3,5-dienoate

Systemtic Name: ethyl (3E,5Z)-6-(4-methylphenyl)-5-methylsulfanyl-6-oxidanyl-2-oxidanylidene-hexa-3,5-dienoate Openeye Name: ethyl (3E,5Z)-6-hydroxy-5-methylsulfanyl-2-oxo-6-(p-tolyl)hexa-3,5-dienoate CAS Name: (3E,5Z)-6-hydroxy-6-(4-methylphenyl)-5-(methylthio)-2-oxohexa-3,5-dienoic acid ethyl ester IUPAC Name: ethyl (3E,5Z)-6-hydroxy-6-(4-methylphenyl)-5-methylsulfanyl-2-oxohexa-3,5-dienoate Traditional Name: (3E,5Z)-6-hydroxy-2-keto-5-(methylthio)-6-(p-tolyl)hexa-3,5-dienoic acid ethyl ester Formula: C16H18O4S MolecularWeight: 306.37672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(=O)/C=C/C(=C(\C1=CC=C(C=C1)C)/O)/SC

InChI

InChI=1S/C16H18O4S/c1-4-20-16(19)13(17)9-10-14(21-3)15(18)12-7-5-11(2)6-8-12/h5-10,18H,4H2,1-3H3/b10-9+,15-14-