1-[3-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxy-2-methyl-pyridin-4-yl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxy-2-methyl-pyridin-4-yl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxy-2-methyl-4-pyridyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]oxy]-2-methyl-4-pyridinyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxy-2-methylpyridin-4-yl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]oxy-2-methyl-4-pyridyl]-4-methyl-piperazin-4-ium Formula: C17H20ClF3N4O+2 MolecularWeight: 388.81511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1OC2=C(C=C(C=[NH+]2)C(F)(F)F)Cl)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=NC=CC(=C1OC2=C(C=C(C=[NH+]2)C(F)(F)F)Cl)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H18ClF3N4O/c1-11-15(14(3-4-22-11)25-7-5-24(2)6-8-25)26-16-13(18)9-12(10-23-16)17(19,20)21/h3-4,9-10H,5-8H2,1-2H3/p+2