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

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2,3-dimethylphenyl)piperazine Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,3-dimethylphenyl)piperazine CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,3-dimethylphenyl)piperazine IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,3-dimethylphenyl)piperazine Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2,3-dimethylphenyl)piperazine Formula: C19H20BrF3N2O3S MolecularWeight: 493.33791

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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