dimethyl-octadecyl-(phenylmethyl)azanium

Systemtic Name: dimethyl-octadecyl-(phenylmethyl)azanium Openeye Name: benzyl-dimethyl-octadecyl-ammonium CAS Name: dimethyl-octadecyl-(phenylmethyl)ammonium IUPAC Name: benzyl-dimethyl-octadecylazanium Traditional Name: benzyl-dimethyl-stearyl-ammonium Formula: C27H50N+ MolecularWeight: 388.6926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1

InChI

InChI=1S/C27H50N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27/h19-21,23-24H,4-18,22,25-26H2,1-3H3/q+1