3-pyrazol-1-yl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]propanamide

Systemtic Name: 3-pyrazol-1-yl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]propanamide Openeye Name: 3-pyrazol-1-yl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]-3-piperidyl]propanamide CAS Name: 3-(1-pyrazolyl)-N-[(3S)-1-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-3-piperidinyl]propanamide IUPAC Name: 3-pyrazol-1-yl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidin-3-yl]propanamide Traditional Name: 3-pyrazol-1-yl-N-[(3S)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]-3-piperidyl]propionamide Formula: C17H21F3N5O+ MolecularWeight: 368.37675

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=[NH+]C=C(C=C2)C(F)(F)F)NC(=O)CCN3C=CC=N3

Isomeric SMILES

C1C[C@@H](CN(C1)C2=[NH+]C=C(C=C2)C(F)(F)F)NC(=O)CCN3C=CC=N3

InChI

InChI=1S/C17H20F3N5O/c18-17(19,20)13-4-5-15(21-11-13)24-8-1-3-14(12-24)23-16(26)6-10-25-9-2-7-22-25/h2,4-5,7,9,11,14H,1,3,6,8,10,12H2,(H,23,26)/p+1/t14-/m0/s1