3-[4-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: 3-[4-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]piperazin-1-ium-1-yl]propanamide Openeye Name: 3-[4-[6-methyl-4-(trifluoromethyl)-2-pyridyl]piperazin-1-ium-1-yl]propanamide CAS Name: 3-[4-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: 3-[4-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]piperazin-1-ium-1-yl]propanamide Traditional Name: 3-[4-[6-methyl-4-(trifluoromethyl)-2-pyridyl]piperazin-1-ium-1-yl]propionamide Formula: C14H20F3N4O+ MolecularWeight: 317.33001

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)C(F)(F)F)N2CC[NH+](CC2)CCC(=O)N

Isomeric SMILES

CC1=NC(=CC(=C1)C(F)(F)F)N2CC[NH+](CC2)CCC(=O)N

InChI

InChI=1S/C14H19F3N4O/c1-10-8-11(14(15,16)17)9-13(19-10)21-6-4-20(5-7-21)3-2-12(18)22/h8-9H,2-7H2,1H3,(H2,18,22)/p+1