1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)piperidin-1-ium-4-carboxamide Formula: C13H17ClFN2O+ MolecularWeight: 271.738283

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C13H16ClFN2O/c14-11-2-1-3-12(15)10(11)8-17-6-4-9(5-7-17)13(16)18/h1-3,9H,4-8H2,(H2,16,18)/p+1