(1-oxidanidylpyridin-1-ium-2-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (1-oxidanidylpyridin-1-ium-2-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Openeye Name: (1-oxidopyridin-1-ium-2-yl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone CAS Name: (1-oxido-2-pyridin-1-iumyl)-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (1-oxidopyridin-1-ium-2-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Traditional Name: (1-oxidopyridin-1-ium-2-yl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methanone Formula: C16H15F3N4O2 MolecularWeight: 352.31111

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C16H15F3N4O2/c17-16(18,19)12-4-5-14(20-11-12)21-7-9-22(10-8-21)15(24)13-3-1-2-6-23(13)25/h1-6,11H,7-10H2