4-chloranyl-3-fluoranyl-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 4-chloranyl-3-fluoranyl-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]benzamide Openeye Name: 4-chloro-3-fluoro-N-[[2-[(3S)-3-hydroxy-1-piperidyl]pyridin-1-ium-3-yl]methyl]benzamide CAS Name: 4-chloro-3-fluoro-N-[[2-[(3S)-3-hydroxy-1-piperidinyl]-3-pyridin-1-iumyl]methyl]benzamide IUPAC Name: 4-chloro-3-fluoro-N-[[2-[(3S)-3-hydroxypiperidin-1-yl]pyridin-1-ium-3-yl]methyl]benzamide Traditional Name: 4-chloro-3-fluoro-N-[[2-[(3S)-3-hydroxypiperidino]pyridin-1-ium-3-yl]methyl]benzamide Formula: C18H20ClFN3O2+ MolecularWeight: 364.821703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=CC=[NH+]2)CNC(=O)C3=CC(=C(C=C3)Cl)F)O

Isomeric SMILES

C1C[C@@H](CN(C1)C2=C(C=CC=[NH+]2)CNC(=O)C3=CC(=C(C=C3)Cl)F)O

InChI

InChI=1S/C18H19ClFN3O2/c19-15-6-5-12(9-16(15)20)18(25)22-10-13-3-1-7-21-17(13)23-8-2-4-14(24)11-23/h1,3,5-7,9,14,24H,2,4,8,10-11H2,(H,22,25)/p+1/t14-/m0/s1