1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,6-dimethylphenyl)piperazine Formula: C19H20BrF3N2O3S MolecularWeight: 493.33791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrF3N2O3S/c1-13-4-3-5-14(2)18(13)24-8-10-25(11-9-24)29(26,27)17-7-6-15(20)12-16(17)28-19(21,22)23/h3-7,12H,8-11H2,1-2H3