(5R)-5-[[[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]methyl]-N-pyridin-3-yl-4,5-dihydro-1,2-oxazole-3-carboxamide

Systemtic Name: (5R)-5-[[[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]methyl]-N-pyridin-3-yl-4,5-dihydro-1,2-oxazole-3-carboxamide Openeye Name: (5R)-5-[[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]methyl]-N-(3-pyridyl)-4,5-dihydroisoxazole-3-carboxamide CAS Name: (5R)-5-[[[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]amino]methyl]-N-(3-pyridinyl)-4,5-dihydroisoxazole-3-carboxamide IUPAC Name: (5R)-5-[[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]methyl]-N-pyridin-3-yl-4,5-dihydro-1,2-oxazole-3-carboxamide Traditional Name: (5R)-5-[[[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]amino]methyl]-N-(3-pyridyl)-2-isoxazoline-3-carboxamide Formula: C16H14ClF3N5O2+ MolecularWeight: 400.76287

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C(=O)NC2=CN=CC=C2)CNC3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1[C@@H](ON=C1C(=O)NC2=CN=CC=C2)CNC3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C16H13ClF3N5O2/c17-12-4-9(16(18,19)20)6-22-14(12)23-8-11-5-13(25-27-11)15(26)24-10-2-1-3-21-7-10/h1-4,6-7,11H,5,8H2,(H,22,23)(H,24,26)/p+1/t11-/m1/s1