1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide bromide

Systemtic Name: 1-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide bromide Openeye Name: 1-[2-(4-fluorophenyl)-2-oxo-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide bromide CAS Name: 1-[2-(4-fluorophenyl)-2-oxoethyl]-N-(2-hydroxyethyl)-4-pyridin-1-iumcarboxamide bromide IUPAC Name: 1-[2-(4-fluorophenyl)-2-oxoethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide bromide Traditional Name: 1-[2-(4-fluorophenyl)-2-keto-ethyl]-N-(2-hydroxyethyl)pyridin-1-ium-4-carboxamide bromide Formula: C16H16BrFN2O3 MolecularWeight: 383.212243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C[N+]2=CC=C(C=C2)C(=O)NCCO)F.[Br-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C[N+]2=CC=C(C=C2)C(=O)NCCO)F.[Br-]

InChI

InChI=1S/C16H15FN2O3.BrH/c17-14-3-1-12(2-4-14)15(21)11-19-8-5-13(6-9-19)16(22)18-7-10-20;/h1-6,8-9,20H,7,10-11H2;1H