1-(2-fluorophenyl)-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide Openeye Name: 1-(2-fluorophenyl)-N-[[2-[(3S)-3-hydroxy-1-piperidyl]pyridin-1-ium-3-yl]methyl]cyclopropanecarboxamide CAS Name: 1-(2-fluorophenyl)-N-[[2-[(3S)-3-hydroxy-1-piperidinyl]-3-pyridin-1-iumyl]methyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(2-fluorophenyl)-N-[[2-[(3S)-3-hydroxypiperidin-1-yl]pyridin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-[[2-[(3S)-3-hydroxypiperidino]pyridin-1-ium-3-yl]methyl]cyclopropanecarboxamide Formula: C21H25FN3O2+ MolecularWeight: 370.440503

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=CC=[NH+]2)CNC(=O)C3(CC3)C4=CC=CC=C4F)O

Isomeric SMILES

C1C[C@@H](CN(C1)C2=C(C=CC=[NH+]2)CNC(=O)C3(CC3)C4=CC=CC=C4F)O

InChI

InChI=1S/C21H24FN3O2/c22-18-8-2-1-7-17(18)21(9-10-21)20(27)24-13-15-5-3-11-23-19(15)25-12-4-6-16(26)14-25/h1-3,5,7-8,11,16,26H,4,6,9-10,12-14H2,(H,24,27)/p+1/t16-/m0/s1