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2-[carboxymethylsulfanyl-(4-methoxyphenyl)methyl]sulfanylethanoic acid

2-[carboxymethylsulfanyl-(4-methoxyphenyl)methyl]sulfanylethanoic acid

Systemtic Name:2-[carboxymethylsulfanyl-(4-methoxyphenyl)methyl]sulfanylethanoic acid
Openeye Name:2-[carboxymethylsulfanyl-(4-methoxyphenyl)methyl]sulfanylacetic acid
CAS Name:2-[[(carboxymethylthio)-(4-methoxyphenyl)methyl]thio]acetic acid
IUPAC Name:2-[carboxymethylsulfanyl-(4-methoxyphenyl)methyl]sulfanylacetic acid
Traditional Name:2-[[(carboxymethylthio)-(4-methoxyphenyl)methyl]thio]acetic acid
Formula: C12H14O5S2
MolecularWeight: 302.36656
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(SCC(=O)O)SCC(=O)O


Isomeric SMILES

COC1=CC=C(C=C1)C(SCC(=O)O)SCC(=O)O


InChI

InChI=1S/C12H14O5S2/c1-17-9-4-2-8(3-5-9)12(18-6-10(13)14)19-7-11(15)16/h2-5,12H,6-7H2,1H3,(H,13,14)(H,15,16)


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