icosyl-dimethyl-(phenylmethyl)azanium

Systemtic Name: icosyl-dimethyl-(phenylmethyl)azanium Openeye Name: benzyl-icosyl-dimethyl-ammonium CAS Name: eicosyl-dimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-icosyl-dimethylazanium Traditional Name: arachyl-benzyl-dimethyl-ammonium Formula: C29H54N+ MolecularWeight: 416.74576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H54N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-30(2,3)28-29-25-22-21-23-26-29/h21-23,25-26H,4-20,24,27-28H2,1-3H3/q+1