2-(dimethylazaniumyl)ethyl-ethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: 2-(dimethylazaniumyl)ethyl-ethyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(dimethylammonio)ethyl]-ethyl-ammonium CAS Name: 2-(dimethylammonio)ethyl-ethyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(dimethylazaniumyl)ethyl]-ethylazanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(dimethylammonio)ethyl]-ethyl-ammonium Formula: C18H34N3+3 MolecularWeight: 292.48266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC[NH+](C)C)C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC[NH+](C)C)C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H31N3/c1-4-21(15-14-19(2)3)18-10-12-20(13-11-18)16-17-8-6-5-7-9-17/h5-9,18H,4,10-16H2,1-3H3/p+3