(E)-3-(2-chloranyl-6-fluoranyl-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(2-chloranyl-6-fluoranyl-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide Openeye Name: (E)-3-(2-chloro-6-fluoro-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide CAS Name: (E)-3-(2-chloro-6-fluorophenyl)-N-(1-propyl-4-piperidin-1-iumyl)-2-propenamide IUPAC Name: (E)-3-(2-chloro-6-fluorophenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide Traditional Name: (E)-3-(2-chloro-6-fluoro-phenyl)-N-(1-propylpiperidin-1-ium-4-yl)acrylamide Formula: C17H23ClFN2O+ MolecularWeight: 325.828723

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C=CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)/C=C/C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C17H22ClFN2O/c1-2-10-21-11-8-13(9-12-21)20-17(22)7-6-14-15(18)4-3-5-16(14)19/h3-7,13H,2,8-12H2,1H3,(H,20,22)/p+1/b7-6+