3-nitro-5-[4-(trifluoromethyl)phenyl]sulfanyl-aniline

Systemtic Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]sulfanyl-aniline Openeye Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]sulfanyl-aniline CAS Name: 3-nitro-5-[[4-(trifluoromethyl)phenyl]thio]aniline IUPAC Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]sulfanylaniline Traditional Name: [3-nitro-5-[[4-(trifluoromethyl)phenyl]thio]phenyl]amine Formula: C13H9F3N2O2S MolecularWeight: 314.28297

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)SC2=CC(=CC(=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)SC2=CC(=CC(=C2)[N+](=O)[O-])N

InChI

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