N-(5-azanyl-2-fluoranyl-phenyl)-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(5-azanyl-2-fluoranyl-phenyl)-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(5-amino-2-fluoro-phenyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(5-amino-2-fluorophenyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(5-amino-2-fluorophenyl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(5-amino-2-fluoro-phenyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C13H19FN3O+ MolecularWeight: 252.307863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)N)F

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)N)F

InChI

InChI=1S/C13H18FN3O/c14-11-5-4-10(15)8-12(11)16-13(18)9-17-6-2-1-3-7-17/h4-5,8H,1-3,6-7,9,15H2,(H,16,18)/p+1