1-ethyl-3-(1-methylpyrrolidin-2-yl)pyridin-1-ium iodide

Systemtic Name: 1-ethyl-3-(1-methylpyrrolidin-2-yl)pyridin-1-ium iodide Openeye Name: 1-ethyl-3-(1-methylpyrrolidin-2-yl)pyridin-1-ium iodide CAS Name: 1-ethyl-3-(1-methyl-2-pyrrolidinyl)pyridin-1-ium iodide IUPAC Name: 1-ethyl-3-(1-methylpyrrolidin-2-yl)pyridin-1-ium iodide Traditional Name: 1-ethyl-3-(1-methylpyrrolidin-2-yl)pyridin-1-ium iodide Formula: C12H19IN2 MolecularWeight: 318.19713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1)C2CCCN2C.[I-]

Isomeric SMILES

CC[N+]1=CC=CC(=C1)C2CCCN2C.[I-]

InChI

InChI=1S/C12H19N2.HI/c1-3-14-9-4-6-11(10-14)12-7-5-8-13(12)2;/h4,6,9-10,12H,3,5,7-8H2,1-2H3;1H/q+1;/p-1