2-[2-nitro-6-(trifluoromethyl)phenyl]sulfanylaniline

Systemtic Name: 2-[2-nitro-6-(trifluoromethyl)phenyl]sulfanylaniline Openeye Name: 2-[2-nitro-6-(trifluoromethyl)phenyl]sulfanylaniline CAS Name: 2-[[2-nitro-6-(trifluoromethyl)phenyl]thio]aniline IUPAC Name: 2-[2-nitro-6-(trifluoromethyl)phenyl]sulfanylaniline Traditional Name: [2-[[2-nitro-6-(trifluoromethyl)phenyl]thio]phenyl]amine Formula: C13H9F3N2O2S MolecularWeight: 314.28297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)SC2=C(C=CC=C2[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)N)SC2=C(C=CC=C2[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H9F3N2O2S/c14-13(15,16)8-4-3-6-10(18(19)20)12(8)21-11-7-2-1-5-9(11)17/h1-7H,17H2