2-(2-chloranyl-6-fluoranyl-phenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(2-chloranyl-6-fluoranyl-phenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(2-chloro-6-fluoro-phenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(2-chloro-6-fluorophenyl)-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(2-chloro-6-fluorophenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(2-chloro-6-fluoro-phenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]acetamide Formula: C21H25ClFN2O+ MolecularWeight: 375.887403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H24ClFN2O/c22-19-5-4-6-20(23)18(19)13-21(26)24-14-16-7-9-17(10-8-16)15-25-11-2-1-3-12-25/h4-10H,1-3,11-15H2,(H,24,26)/p+1