2-[[3-[bis(fluoranyl)methoxy]phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[[3-[bis(fluoranyl)methoxy]phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[3-(difluoromethoxy)benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[[3-(difluoromethoxy)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[3-(difluoromethoxy)benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[3-(difluoromethoxy)benzoyl]amino]-4-(methylthio)butyric acid Formula: C13H15F2NO4S MolecularWeight: 319.324306

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)OC(F)F

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1=CC(=CC=C1)OC(F)F

InChI

InChI=1S/C13H15F2NO4S/c1-21-6-5-10(12(18)19)16-11(17)8-3-2-4-9(7-8)20-13(14)15/h2-4,7,10,13H,5-6H2,1H3,(H,16,17)(H,18,19)