1-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(5-bromo-2-ethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(5-bromo-2-ethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C19H20BrF3N2O3S MolecularWeight: 493.33791

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

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