2-[carboxymethylsulfanyl-(2-ethoxyphenyl)methyl]sulfanylethanoic acid

Systemtic Name: 2-[carboxymethylsulfanyl-(2-ethoxyphenyl)methyl]sulfanylethanoic acid Openeye Name: 2-[carboxymethylsulfanyl-(2-ethoxyphenyl)methyl]sulfanylacetic acid CAS Name: 2-[[(carboxymethylthio)-(2-ethoxyphenyl)methyl]thio]acetic acid IUPAC Name: 2-[carboxymethylsulfanyl-(2-ethoxyphenyl)methyl]sulfanylacetic acid Traditional Name: 2-[[(carboxymethylthio)-o-phenetyl-methyl]thio]acetic acid Formula: C13H16O5S2 MolecularWeight: 316.39314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(SCC(=O)O)SCC(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C(SCC(=O)O)SCC(=O)O

InChI

InChI=1S/C13H16O5S2/c1-2-18-10-6-4-3-5-9(10)13(19-7-11(14)15)20-8-12(16)17/h3-6,13H,2,7-8H2,1H3,(H,14,15)(H,16,17)