1-(2,3-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-(2,3-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine Openeye Name: 1-(2,3-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine CAS Name: 1-(2,3-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine IUPAC Name: 1-(2,3-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]sulfonylpiperazine Traditional Name: 1-(2,3-dimethylphenyl)-4-[2-(trifluoromethyl)phenyl]sulfonyl-piperazine Formula: C19H21F3N2O2S MolecularWeight: 398.44245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(F)(F)F)C

InChI

InChI=1S/C19H21F3N2O2S/c1-14-6-5-8-17(15(14)2)23-10-12-24(13-11-23)27(25,26)18-9-4-3-7-16(18)19(20,21)22/h3-9H,10-13H2,1-2H3