1-[3-[(4-chloranyl-2-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]-N-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-[(4-chloranyl-2-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]-N-methyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-(4-chloro-2-fluoro-anilino)-3-oxo-propyl]-N-methyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[3-(4-chloro-2-fluoroanilino)-3-oxopropyl]-N-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-(4-chloro-2-fluoroanilino)-3-oxopropyl]-N-methylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[3-(4-chloro-2-fluoro-anilino)-3-keto-propyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C16H22ClFN3O2+ MolecularWeight: 342.816183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC[NH+](CC1)CCC(=O)NC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CNC(=O)C1CC[NH+](CC1)CCC(=O)NC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C16H21ClFN3O2/c1-19-16(23)11-4-7-21(8-5-11)9-6-15(22)20-14-3-2-12(17)10-13(14)18/h2-3,10-11H,4-9H2,1H3,(H,19,23)(H,20,22)/p+1