methyl 4-(3-methoxyphenyl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(3-methoxyphenyl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: methyl 4-(3-methoxyphenyl)sulfanyl-3-oxo-butanoate CAS Name: 4-[(3-methoxyphenyl)thio]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(3-methoxyphenyl)sulfanyl-3-oxobutanoate Traditional Name: 3-keto-4-[(3-methoxyphenyl)thio]butyric acid methyl ester Formula: C12H14O4S MolecularWeight: 254.30216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCC(=O)CC(=O)OC

Isomeric SMILES

COC1=CC(=CC=C1)SCC(=O)CC(=O)OC

InChI

InChI=1S/C12H14O4S/c1-15-10-4-3-5-11(7-10)17-8-9(13)6-12(14)16-2/h3-5,7H,6,8H2,1-2H3