2-[3,4-bis(bromomethyl)phenyl]carbonyloxyethyl-trimethyl-azanium iodide

Systemtic Name: 2-[3,4-bis(bromomethyl)phenyl]carbonyloxyethyl-trimethyl-azanium iodide Openeye Name: 2-[3,4-bis(bromomethyl)benzoyl]oxyethyl-trimethyl-ammonium iodide CAS Name: 2-[[3,4-bis(bromomethyl)phenyl]-oxomethoxy]ethyl-trimethylammonium iodide IUPAC Name: 2-[3,4-bis(bromomethyl)benzoyl]oxyethyl-trimethylazanium iodide Traditional Name: 2-[3,4-bis(bromomethyl)benzoyl]oxyethyl-trimethyl-ammonium iodide Formula: C14H20Br2INO2 MolecularWeight: 521.02657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC(=O)C1=CC(=C(C=C1)CBr)CBr.[I-]

Isomeric SMILES

C[N+](C)(C)CCOC(=O)C1=CC(=C(C=C1)CBr)CBr.[I-]

InChI

InChI=1S/C14H20Br2NO2.HI/c1-17(2,3)6-7-19-14(18)11-4-5-12(9-15)13(8-11)10-16;/h4-5,8H,6-7,9-10H2,1-3H3;1H/q+1;/p-1