1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-phenethyl-piperazine

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C19H20BrF3N2O3S/c20-16-6-7-18(17(14-16)28-19(21,22)23)29(26,27)25-12-10-24(11-13-25)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2