N-(1-propan-2-ylpiperidin-1-ium-4-yl)-4-[5-(trifluoromethyl)pyridin-2-yl]oxy-benzamide

Systemtic Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-4-[5-(trifluoromethyl)pyridin-2-yl]oxy-benzamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-4-[[5-(trifluoromethyl)-2-pyridyl]oxy]benzamide CAS Name: N-(1-propan-2-yl-4-piperidin-1-iumyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]benzamide IUPAC Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-4-[5-(trifluoromethyl)pyridin-2-yl]oxybenzamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-4-[[5-(trifluoromethyl)-2-pyridyl]oxy]benzamide Formula: C21H25F3N3O2+ MolecularWeight: 408.43731

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H24F3N3O2/c1-14(2)27-11-9-17(10-12-27)26-20(28)15-3-6-18(7-4-15)29-19-8-5-16(13-25-19)21(22,23)24/h3-8,13-14,17H,9-12H2,1-2H3,(H,26,28)/p+1