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

Systemtic Name: 2-[(2-methoxycarbonylfuran-3-yl)methylsulfanyl]propanoic acid Openeye Name: 2-[(2-methoxycarbonyl-3-furyl)methylsulfanyl]propanoic acid CAS Name: 2-[(2-methoxycarbonyl-3-furanyl)methylthio]propanoic acid IUPAC Name: 2-[(2-methoxycarbonylfuran-3-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(2-carbomethoxy-3-furyl)methylthio]propionic acid Formula: C10H12O5S MolecularWeight: 244.26428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=C(OC=C1)C(=O)OC

Isomeric SMILES

CC(C(=O)O)SCC1=C(OC=C1)C(=O)OC

InChI

InChI=1S/C10H12O5S/c1-6(9(11)12)16-5-7-3-4-15-8(7)10(13)14-2/h3-4,6H,5H2,1-2H3,(H,11,12)