2-[[5-[bis(fluoranyl)methylsulfanylmethyl]furan-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[5-[bis(fluoranyl)methylsulfanylmethyl]furan-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-(difluoromethylsulfanylmethyl)furan-2-carbonyl]amino]acetic acid CAS Name: 2-[[[5-[(difluoromethylthio)methyl]-2-furanyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[5-(difluoromethylsulfanylmethyl)furan-2-carbonyl]amino]acetic acid Traditional Name: 2-[[5-[(difluoromethylthio)methyl]-2-furoyl]amino]acetic acid Formula: C9H9F2NO4S MolecularWeight: 265.233866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)C(=O)NCC(=O)O)CSC(F)F

Isomeric SMILES

C1=C(OC(=C1)C(=O)NCC(=O)O)CSC(F)F

InChI

InChI=1S/C9H9F2NO4S/c10-9(11)17-4-5-1-2-6(16-5)8(15)12-3-7(13)14/h1-2,9H,3-4H2,(H,12,15)(H,13,14)