2-[2-(2-ethoxy-4-methanoyl-phenoxy)ethylsulfanyl]ethanoic acid

Systemtic Name: 2-[2-(2-ethoxy-4-methanoyl-phenoxy)ethylsulfanyl]ethanoic acid Openeye Name: 2-[2-(2-ethoxy-4-formyl-phenoxy)ethylsulfanyl]acetic acid CAS Name: 2-[2-(2-ethoxy-4-formylphenoxy)ethylthio]acetic acid IUPAC Name: 2-[2-(2-ethoxy-4-formylphenoxy)ethylsulfanyl]acetic acid Traditional Name: 2-[2-(2-ethoxy-4-formyl-phenoxy)ethylthio]acetic acid Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O5S/c1-2-17-12-7-10(8-14)3-4-11(12)18-5-6-19-9-13(15)16/h3-4,7-8H,2,5-6,9H2,1H3,(H,15,16)