2-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanylethanoate

Systemtic Name: 2-[2-azanyl-4-(trifluoromethyl)phenyl]sulfanylethanoate Openeye Name: 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanylacetate CAS Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]acetate IUPAC Name: 2-[2-amino-4-(trifluoromethyl)phenyl]sulfanylacetate Traditional Name: 2-[[2-amino-4-(trifluoromethyl)phenyl]thio]acetate Formula: C9H7F3NO2S- MolecularWeight: 250.21759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)N)SCC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)N)SCC(=O)[O-]

InChI

InChI=1S/C9H8F3NO2S/c10-9(11,12)5-1-2-7(6(13)3-5)16-4-8(14)15/h1-3H,4,13H2,(H,14,15)/p-1