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2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid

2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid

Systemtic Name:2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid
Openeye Name:2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid
CAS Name:2-[(2,3,5,6-tetramethylphenyl)thio]butanoic acid
IUPAC Name:2-(2,3,5,6-tetramethylphenyl)sulfanylbutanoic acid
Traditional Name:2-[(2,3,5,6-tetramethylphenyl)thio]butyric acid
Formula: C14H20O2S
MolecularWeight: 252.3724
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=C(C(=CC(=C1C)C)C)C


Isomeric SMILES

CCC(C(=O)O)SC1=C(C(=CC(=C1C)C)C)C


InChI

InChI=1S/C14H20O2S/c1-6-12(14(15)16)17-13-10(4)8(2)7-9(3)11(13)5/h7,12H,6H2,1-5H3,(H,15,16)


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