1-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C14H18BrFN3O2+ MolecularWeight: 359.214023

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C14H17BrFN3O2/c15-10-1-2-12(11(16)7-10)18-13(20)8-19-5-3-9(4-6-19)14(17)21/h1-2,7,9H,3-6,8H2,(H2,17,21)(H,18,20)/p+1