N-[2-(2-chloranyl-4-fluoranyl-phenyl)ethyl]-5-ethoxy-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[2-(2-chloranyl-4-fluoranyl-phenyl)ethyl]-5-ethoxy-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[2-(2-chloro-4-fluoro-phenyl)ethyl]-5-ethoxy-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[2-(2-chloro-4-fluorophenyl)ethyl]-5-ethoxy-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[2-(2-chloro-4-fluorophenyl)ethyl]-5-ethoxy-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[2-(2-chloro-4-fluoro-phenyl)ethyl]-5-ethoxy-1-oxido-pyridin-1-ium-3-carboxamide Formula: C16H16ClFN2O3 MolecularWeight: 338.761243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C[N+](=CC(=C1)C(=O)NCCC2=C(C=C(C=C2)F)Cl)[O-]

Isomeric SMILES

CCOC1=C[N+](=CC(=C1)C(=O)NCCC2=C(C=C(C=C2)F)Cl)[O-]

InChI

InChI=1S/C16H16ClFN2O3/c1-2-23-14-7-12(9-20(22)10-14)16(21)19-6-5-11-3-4-13(18)8-15(11)17/h3-4,7-10H,2,5-6H2,1H3,(H,19,21)