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2-methoxy-5-methylsulfanyl-benzoic acid

2-methoxy-5-methylsulfanyl-benzoic acid

Systemtic Name:2-methoxy-5-methylsulfanyl-benzoic acid
Openeye Name:2-methoxy-5-methylsulfanyl-benzoic acid
CAS Name:2-methoxy-5-(methylthio)benzoic acid
IUPAC Name:2-methoxy-5-methylsulfanylbenzoic acid
Traditional Name:2-methoxy-5-(methylthio)benzoic acid
Formula: C9H10O3S
MolecularWeight: 198.2389
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SC)C(=O)O


Isomeric SMILES

COC1=C(C=C(C=C1)SC)C(=O)O


InChI

InChI=1S/C9H10O3S/c1-12-8-4-3-6(13-2)5-7(8)9(10)11/h3-5H,1-2H3,(H,10,11)


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