2-[2-azanyl-4-(trifluoromethylsulfonyl)phenyl]sulfanylethanoic acid

Systemtic Name: 2-[2-azanyl-4-(trifluoromethylsulfonyl)phenyl]sulfanylethanoic acid Openeye Name: 2-[2-amino-4-(trifluoromethylsulfonyl)phenyl]sulfanylacetic acid CAS Name: 2-[[2-amino-4-(trifluoromethylsulfonyl)phenyl]thio]acetic acid IUPAC Name: 2-[2-amino-4-(trifluoromethylsulfonyl)phenyl]sulfanylacetic acid Traditional Name: 2-[(2-amino-4-triflyl-phenyl)thio]acetic acid Formula: C9H8F3NO4S2 MolecularWeight: 315.28933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)N)SCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)C(F)(F)F)N)SCC(=O)O

InChI

InChI=1S/C9H8F3NO4S2/c10-9(11,12)19(16,17)5-1-2-7(6(13)3-5)18-4-8(14)15/h1-3H,4,13H2,(H,14,15)