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2-[1-(3,4-dimethylphenyl)-2-ethoxy-2-oxidanylidene-ethyl]sulfanylbutanoic acid

2-[1-(3,4-dimethylphenyl)-2-ethoxy-2-oxidanylidene-ethyl]sulfanylbutanoic acid

Systemtic Name:2-[1-(3,4-dimethylphenyl)-2-ethoxy-2-oxidanylidene-ethyl]sulfanylbutanoic acid
Openeye Name:2-[1-(3,4-dimethylphenyl)-2-ethoxy-2-oxo-ethyl]sulfanylbutanoic acid
CAS Name:2-[[1-(3,4-dimethylphenyl)-2-ethoxy-2-oxoethyl]thio]butanoic acid
IUPAC Name:2-[1-(3,4-dimethylphenyl)-2-ethoxy-2-oxoethyl]sulfanylbutanoic acid
Traditional Name:2-[[1-(3,4-dimethylphenyl)-2-ethoxy-2-keto-ethyl]thio]butyric acid
Formula: C16H22O4S
MolecularWeight: 310.40848
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC(C1=CC(=C(C=C1)C)C)C(=O)OCC


Isomeric SMILES

CCC(C(=O)O)SC(C1=CC(=C(C=C1)C)C)C(=O)OCC


InChI

InChI=1S/C16H22O4S/c1-5-13(15(17)18)21-14(16(19)20-6-2)12-8-7-10(3)11(4)9-12/h7-9,13-14H,5-6H2,1-4H3,(H,17,18)


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