3-(1-methylpyridin-1-ium-4-yl)-N-phenyl-propanamide iodide

Systemtic Name: 3-(1-methylpyridin-1-ium-4-yl)-N-phenyl-propanamide iodide Openeye Name: 3-(1-methylpyridin-1-ium-4-yl)-N-phenyl-propanamide iodide CAS Name: 3-(1-methyl-4-pyridin-1-iumyl)-N-phenylpropanamide iodide IUPAC Name: 3-(1-methylpyridin-1-ium-4-yl)-N-phenylpropanamide iodide Traditional Name: 3-(1-methylpyridin-1-ium-4-yl)-N-phenyl-propionamide iodide Formula: C15H17IN2O MolecularWeight: 368.21275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O.HI/c1-17-11-9-13(10-12-17)7-8-15(18)16-14-5-3-2-4-6-14;/h2-6,9-12H,7-8H2,1H3;1H