(E)-N-(4-methylpiperazin-4-ium-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-N-(4-methyl-1-piperazin-4-iumyl)-3-[3-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-[3-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-(4-methylpiperazin-4-ium-1-yl)-3-[3-(trifluoromethyl)phenyl]acrylamide Formula: C15H19F3N3O+ MolecularWeight: 314.32607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C=CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C15H18F3N3O/c1-20-7-9-21(10-8-20)19-14(22)6-5-12-3-2-4-13(11-12)15(16,17)18/h2-6,11H,7-10H2,1H3,(H,19,22)/p+1/b6-5+