2-[3-[3,4-bis(fluoranyl)phenyl]sulfanylpropanoyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[3-[3,4-bis(fluoranyl)phenyl]sulfanylpropanoyl-methyl-amino]ethanoic acid Openeye Name: 2-[3-(3,4-difluorophenyl)sulfanylpropanoyl-methyl-amino]acetic acid CAS Name: 2-[[3-[(3,4-difluorophenyl)thio]-1-oxopropyl]-methylamino]acetic acid IUPAC Name: 2-[3-(3,4-difluorophenyl)sulfanylpropanoyl-methylamino]acetic acid Traditional Name: 2-[3-[(3,4-difluorophenyl)thio]propanoyl-methyl-amino]acetic acid Formula: C12H13F2NO3S MolecularWeight: 289.298326

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)CCSC1=CC(=C(C=C1)F)F

Isomeric SMILES

CN(CC(=O)O)C(=O)CCSC1=CC(=C(C=C1)F)F

InChI

InChI=1S/C12H13F2NO3S/c1-15(7-12(17)18)11(16)4-5-19-8-2-3-9(13)10(14)6-8/h2-3,6H,4-5,7H2,1H3,(H,17,18)