1-(2,6-dimethyloctyl)-1-prop-2-enyl-piperidin-1-ium bromide

Systemtic Name: 1-(2,6-dimethyloctyl)-1-prop-2-enyl-piperidin-1-ium bromide Openeye Name: 1-allyl-1-(2,6-dimethyloctyl)piperidin-1-ium bromide CAS Name: 1-(2,6-dimethyloctyl)-1-prop-2-enylpiperidin-1-ium bromide IUPAC Name: 1-(2,6-dimethyloctyl)-1-prop-2-enylpiperidin-1-ium bromide Traditional Name: 1-allyl-1-(2,6-dimethyloctyl)piperidin-1-ium bromide Formula: C18H36BrN MolecularWeight: 346.38914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCC(C)C[N+]1(CCCCC1)CC=C.[Br-]

Isomeric SMILES

CCC(C)CCCC(C)C[N+]1(CCCCC1)CC=C.[Br-]

InChI

InChI=1S/C18H36N.BrH/c1-5-13-19(14-8-7-9-15-19)16-18(4)12-10-11-17(3)6-2;/h5,17-18H,1,6-16H2,2-4H3;1H/q+1;/p-1