(2R)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)-2-[3-(trifluoromethyl)phenoxy]propan-1-one

Systemtic Name: (2R)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)-2-[3-(trifluoromethyl)phenoxy]propan-1-one Openeye Name: (2R)-1-(4-allylpiperazin-4-ium-1-yl)-2-[3-(trifluoromethyl)phenoxy]propan-1-one CAS Name: (2R)-1-(4-prop-2-enyl-1-piperazin-4-iumyl)-2-[3-(trifluoromethyl)phenoxy]-1-propanone IUPAC Name: (2R)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)-2-[3-(trifluoromethyl)phenoxy]propan-1-one Traditional Name: (2R)-1-(4-allylpiperazin-4-ium-1-yl)-2-[3-(trifluoromethyl)phenoxy]propan-1-one Formula: C17H22F3N2O2+ MolecularWeight: 343.36399

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)CC=C)OC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)N1CC[NH+](CC1)CC=C)OC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C17H21F3N2O2/c1-3-7-21-8-10-22(11-9-21)16(23)13(2)24-15-6-4-5-14(12-15)17(18,19)20/h3-6,12-13H,1,7-11H2,2H3/p+1/t13-/m1/s1