2-[2-(carboxymethylsulfanyl)-6-ethoxy-phenyl]ethanoic acid

Systemtic Name: 2-[2-(carboxymethylsulfanyl)-6-ethoxy-phenyl]ethanoic acid Openeye Name: 2-[2-(carboxymethylsulfanyl)-6-ethoxy-phenyl]acetic acid CAS Name: 2-[2-(carboxymethylthio)-6-ethoxyphenyl]acetic acid IUPAC Name: 2-[2-(carboxymethylsulfanyl)-6-ethoxyphenyl]acetic acid Traditional Name: 2-[2-(carboxymethylthio)-6-ethoxy-phenyl]acetic acid Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC=C1)SCC(=O)O)CC(=O)O

Isomeric SMILES

CCOC1=C(C(=CC=C1)SCC(=O)O)CC(=O)O

InChI

InChI=1S/C12H14O5S/c1-2-17-9-4-3-5-10(18-7-12(15)16)8(9)6-11(13)14/h3-5H,2,6-7H2,1H3,(H,13,14)(H,15,16)