1-oxidanidyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-oxidanidyl-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]pyridin-1-ium-4-carboxamide Openeye Name: 1-oxido-N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]pyridin-1-ium-4-carboxamide CAS Name: 1-oxido-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]pyridin-1-ium-4-carboxamide Traditional Name: 1-oxido-N-[2-piperidino-5-(trifluoromethyl)phenyl]pyridin-1-ium-4-carboxamide Formula: C18H18F3N3O2 MolecularWeight: 365.34963

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C18H18F3N3O2/c19-18(20,21)14-4-5-16(23-8-2-1-3-9-23)15(12-14)22-17(25)13-6-10-24(26)11-7-13/h4-7,10-12H,1-3,8-9H2,(H,22,25)