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4-(4-methylsulfanylphenyl)-3-oxidanylidene-butanoic acid

4-(4-methylsulfanylphenyl)-3-oxidanylidene-butanoic acid

Systemtic Name:4-(4-methylsulfanylphenyl)-3-oxidanylidene-butanoic acid
Openeye Name:4-(4-methylsulfanylphenyl)-3-oxo-butanoic acid
CAS Name:4-[4-(methylthio)phenyl]-3-oxobutanoic acid
IUPAC Name:4-(4-methylsulfanylphenyl)-3-oxobutanoic acid
Traditional Name:3-keto-4-[4-(methylthio)phenyl]butyric acid
Formula: C11H12O3S
MolecularWeight: 224.27618
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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC(=O)CC(=O)O


Isomeric SMILES

CSC1=CC=C(C=C1)CC(=O)CC(=O)O


InChI

InChI=1S/C11H12O3S/c1-15-10-4-2-8(3-5-10)6-9(12)7-11(13)14/h2-5H,6-7H2,1H3,(H,13,14)


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