2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]sulfanylethanoate

Systemtic Name: 2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]sulfanylethanoate Openeye Name: 2-[2-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]sulfanylacetate CAS Name: 2-[[2-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]thio]acetate IUPAC Name: 2-[2-oxo-2-[[3-(trifluoromethyl)phenyl]methylamino]ethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[[3-(trifluoromethyl)benzyl]amino]ethyl]thio]acetate Formula: C12H11F3NO3S- MolecularWeight: 306.28085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CSCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CNC(=O)CSCC(=O)[O-]

InChI

InChI=1S/C12H12F3NO3S/c13-12(14,15)9-3-1-2-8(4-9)5-16-10(17)6-20-7-11(18)19/h1-4H,5-7H2,(H,16,17)(H,18,19)/p-1