3-(2-chloranyl-6-fluoranyl-phenyl)-N-(pyridin-1-ium-4-ylmethyl)prop-2-enamide

Systemtic Name: 3-(2-chloranyl-6-fluoranyl-phenyl)-N-(pyridin-1-ium-4-ylmethyl)prop-2-enamide Openeye Name: 3-(2-chloro-6-fluoro-phenyl)-N-(pyridin-1-ium-4-ylmethyl)prop-2-enamide CAS Name: 3-(2-chloro-6-fluorophenyl)-N-(4-pyridin-1-iumylmethyl)-2-propenamide IUPAC Name: 3-(2-chloro-6-fluorophenyl)-N-(pyridin-1-ium-4-ylmethyl)prop-2-enamide Traditional Name: 3-(2-chloro-6-fluoro-phenyl)-N-(pyridin-1-ium-4-ylmethyl)acrylamide Formula: C15H13ClFN2O+ MolecularWeight: 291.727923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C=CC(=O)NCC2=CC=[NH+]C=C2)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C=CC(=O)NCC2=CC=[NH+]C=C2)F

InChI

InChI=1S/C15H12ClFN2O/c16-13-2-1-3-14(17)12(13)4-5-15(20)19-10-11-6-8-18-9-7-11/h1-9H,10H2,(H,19,20)/p+1