1-(3-bromanylphenoxy)-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-2-ol

Systemtic Name: 1-(3-bromanylphenoxy)-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-2-ol Openeye Name: 1-(3-bromophenoxy)-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-2-ol CAS Name: 1-(3-bromophenoxy)-3-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-2-propanol IUPAC Name: 1-(3-bromophenoxy)-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propan-2-ol Traditional Name: 1-(3-bromophenoxy)-3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]propan-2-ol Formula: C20H22BrF3N2O4S MolecularWeight: 523.36389

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC(=CC=C2)Br)O)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(COC2=CC(=CC=C2)Br)O)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H22BrF3N2O4S/c21-16-4-2-5-18(12-16)30-14-17(27)13-25-7-9-26(10-8-25)31(28,29)19-6-1-3-15(11-19)20(22,23)24/h1-6,11-12,17,27H,7-10,13-14H2