(E)-3-(4-bromophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)prop-2-enamide

Systemtic Name: (E)-3-(4-bromophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)prop-2-enamide Openeye Name: (E)-3-(4-bromophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)prop-2-enamide CAS Name: (E)-3-(4-bromophenyl)-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-2-propenamide IUPAC Name: (E)-3-(4-bromophenyl)-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)prop-2-enamide Traditional Name: (E)-3-(4-bromophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)acrylamide Formula: C17H24BrN2O2+ MolecularWeight: 368.28866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C=CC1=CC=C(C=C1)Br)[NH+]2CCOCC2

Isomeric SMILES

CC(C)(CNC(=O)/C=C/C1=CC=C(C=C1)Br)[NH+]2CCOCC2

InChI

InChI=1S/C17H23BrN2O2/c1-17(2,20-9-11-22-12-10-20)13-19-16(21)8-5-14-3-6-15(18)7-4-14/h3-8H,9-13H2,1-2H3,(H,19,21)/p+1/b8-5+