[azanyl-[4-(trifluoromethyl)phenyl]methylidene]azanium; 2-sulfanylethanoate

Systemtic Name: [azanyl-[4-(trifluoromethyl)phenyl]methylidene]azanium; 2-sulfanylethanoate Openeye Name: [amino-[4-(trifluoromethyl)phenyl]methylene]ammonium; 2-sulfanylacetate CAS Name: [amino-[4-(trifluoromethyl)phenyl]methylidene]ammonium; 2-mercaptoacetate IUPAC Name: [amino-[4-(trifluoromethyl)phenyl]methylidene]azanium; 2-sulfanylacetate Traditional Name: [amino-[4-(trifluoromethyl)phenyl]methylene]ammonium; 2-mercaptoacetate Formula: C10H11F3N2O2S MolecularWeight: 280.26675

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=[NH2+])N)C(F)(F)F.C(C(=O)[O-])S

Isomeric SMILES

C1=CC(=CC=C1C(=[NH2+])N)C(F)(F)F.C(C(=O)[O-])S

InChI

InChI=1S/C8H7F3N2.C2H4O2S/c9-8(10,11)6-3-1-5(2-4-6)7(12)13;3-2(4)1-5/h1-4H,(H3,12,13);5H,1H2,(H,3,4)