8-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 8-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 8-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 8-[[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 8-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 8-[[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]methyl]quinoline Formula: C21H20F3N3O2S MolecularWeight: 435.46261

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O2S/c22-21(23,24)18-7-2-8-19(14-18)30(28,29)27-12-10-26(11-13-27)15-17-5-1-4-16-6-3-9-25-20(16)17/h1-9,14H,10-13,15H2