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2-[4-(3,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid

2-[4-(3,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid

Systemtic Name:2-[4-(3,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid
Openeye Name:2-[4-(3,4-dimethoxyphenyl)oxazol-2-yl]-2-sulfanyl-acetic acid
CAS Name:2-[4-(3,4-dimethoxyphenyl)-2-oxazolyl]-2-mercaptoacetic acid
IUPAC Name:2-[4-(3,4-dimethoxyphenyl)-1,3-oxazol-2-yl]-2-sulfanylacetic acid
Traditional Name:2-[4-(3,4-dimethoxyphenyl)oxazol-2-yl]-2-mercapto-acetic acid
Formula: C13H13NO5S
MolecularWeight: 295.31102
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=COC(=N2)C(C(=O)O)S)OC


Isomeric SMILES

COC1=C(C=C(C=C1)C2=COC(=N2)C(C(=O)O)S)OC


InChI

InChI=1S/C13H13NO5S/c1-17-9-4-3-7(5-10(9)18-2)8-6-19-12(14-8)11(20)13(15)16/h3-6,11,20H,1-2H3,(H,15,16)


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