3-(1-methylpyridin-1-ium-3-yl)-N-phenyl-prop-2-enamide iodide

Systemtic Name: 3-(1-methylpyridin-1-ium-3-yl)-N-phenyl-prop-2-enamide iodide Openeye Name: 3-(1-methylpyridin-1-ium-3-yl)-N-phenyl-prop-2-enamide iodide CAS Name: 3-(1-methyl-3-pyridin-1-iumyl)-N-phenyl-2-propenamide iodide IUPAC Name: 3-(1-methylpyridin-1-ium-3-yl)-N-phenylprop-2-enamide iodide Traditional Name: 3-(1-methylpyridin-1-ium-3-yl)-N-phenyl-acrylamide iodide Formula: C15H15IN2O MolecularWeight: 366.19687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C=CC(=O)NC2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C=CC(=O)NC2=CC=CC=C2.[I-]

InChI

InChI=1S/C15H14N2O.HI/c1-17-11-5-6-13(12-17)9-10-15(18)16-14-7-3-2-4-8-14;/h2-12H,1H3;1H