6-bromanyl-4-[4-[4-(trifluoromethylsulfonyl)phenoxy]piperidin-1-yl]quinoline

Systemtic Name: 6-bromanyl-4-[4-[4-(trifluoromethylsulfonyl)phenoxy]piperidin-1-yl]quinoline Openeye Name: 6-bromo-4-[4-[4-(trifluoromethylsulfonyl)phenoxy]-1-piperidyl]quinoline CAS Name: 6-bromo-4-[4-[4-(trifluoromethylsulfonyl)phenoxy]-1-piperidinyl]quinoline IUPAC Name: 6-bromo-4-[4-[4-(trifluoromethylsulfonyl)phenoxy]piperidin-1-yl]quinoline Traditional Name: 6-bromo-4-[4-(4-triflylphenoxy)piperidino]quinoline Formula: C21H18BrF3N2O3S MolecularWeight: 515.34343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)C3=C4C=C(C=CC4=NC=C3)Br

Isomeric SMILES

C1CN(CCC1OC2=CC=C(C=C2)S(=O)(=O)C(F)(F)F)C3=C4C=C(C=CC4=NC=C3)Br

InChI

InChI=1S/C21H18BrF3N2O3S/c22-14-1-6-19-18(13-14)20(7-10-26-19)27-11-8-16(9-12-27)30-15-2-4-17(5-3-15)31(28,29)21(23,24)25/h1-7,10,13,16H,8-9,11-12H2