2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylsulfanyl]acetic acid CAS Name: 2-[[5-(2-furanyl)-3-isoxazolyl]methylthio]acetic acid IUPAC Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylthio]acetic acid Formula: C10H9NO4S MolecularWeight: 239.24776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NO2)CSCC(=O)O

Isomeric SMILES

C1=COC(=C1)C2=CC(=NO2)CSCC(=O)O

InChI

InChI=1S/C10H9NO4S/c12-10(13)6-16-5-7-4-9(15-11-7)8-2-1-3-14-8/h1-4H,5-6H2,(H,12,13)