2-(phenylmethyl)-1,1-bis(prop-2-enyl)piperidin-1-ium iodide

Systemtic Name: 2-(phenylmethyl)-1,1-bis(prop-2-enyl)piperidin-1-ium iodide Openeye Name: 1,1-diallyl-2-benzyl-piperidin-1-ium iodide CAS Name: 2-(phenylmethyl)-1,1-bis(prop-2-enyl)piperidin-1-ium iodide IUPAC Name: 2-benzyl-1,1-bis(prop-2-enyl)piperidin-1-ium iodide Traditional Name: 1,1-diallyl-2-benzyl-piperidin-1-ium iodide Formula: C18H26IN MolecularWeight: 383.31021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1(CCCCC1CC2=CC=CC=C2)CC=C.[I-]

Isomeric SMILES

C=CC[N+]1(CCCCC1CC2=CC=CC=C2)CC=C.[I-]

InChI

InChI=1S/C18H26N.HI/c1-3-13-19(14-4-2)15-9-8-12-18(19)16-17-10-6-5-7-11-17;/h3-7,10-11,18H,1-2,8-9,12-16H2;1H/q+1;/p-1