2-[(2-methoxycarbonylfuran-3-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(2-methoxycarbonylfuran-3-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-methoxycarbonyl-3-furyl)methylsulfanyl]acetic acid CAS Name: 2-[(2-methoxycarbonyl-3-furanyl)methylthio]acetic acid IUPAC Name: 2-[(2-methoxycarbonylfuran-3-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-carbomethoxy-3-furyl)methylthio]acetic acid Formula: C9H10O5S MolecularWeight: 230.2377

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)CSCC(=O)O

Isomeric SMILES

COC(=O)C1=C(C=CO1)CSCC(=O)O

InChI

InChI=1S/C9H10O5S/c1-13-9(12)8-6(2-3-14-8)4-15-5-7(10)11/h2-3H,4-5H2,1H3,(H,10,11)