4-[(1R)-2-nitro-1-[2-(trifluoromethyl)phenyl]ethyl]sulfanylaniline

Systemtic Name: 4-[(1R)-2-nitro-1-[2-(trifluoromethyl)phenyl]ethyl]sulfanylaniline Openeye Name: 4-[(1R)-2-nitro-1-[2-(trifluoromethyl)phenyl]ethyl]sulfanylaniline CAS Name: 4-[[(1R)-2-nitro-1-[2-(trifluoromethyl)phenyl]ethyl]thio]aniline IUPAC Name: 4-[(1R)-2-nitro-1-[2-(trifluoromethyl)phenyl]ethyl]sulfanylaniline Traditional Name: [4-[[(1R)-2-nitro-1-[2-(trifluoromethyl)phenyl]ethyl]thio]phenyl]amine Formula: C15H13F3N2O2S MolecularWeight: 342.33613

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13F3N2O2S/c16-15(17,18)13-4-2-1-3-12(13)14(9-20(21)22)23-11-7-5-10(19)6-8-11/h1-8,14H,9,19H2/t14-/m0/s1