dimethyl-(phenylmethyl)-propyl-azanium; octadecanamide; chloride

Systemtic Name: dimethyl-(phenylmethyl)-propyl-azanium; octadecanamide; chloride Openeye Name: benzyl-dimethyl-propyl-ammonium; octadecanamide; chloride CAS Name: dimethyl-(phenylmethyl)-propylammonium; octadecanamide; chloride IUPAC Name: benzyl-dimethyl-propylazanium; octadecanamide; chloride Traditional Name: benzyl-dimethyl-propyl-ammonium; stearamide; chloride Formula: C30H57ClN2O MolecularWeight: 497.23938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N.CCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N.CCC[N+](C)(C)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C18H37NO.C12H20N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-4-10-13(2,3)11-12-8-6-5-7-9-12;/h2-17H2,1H3,(H2,19,20);5-9H,4,10-11H2,1-3H3;1H/q;+1;/p-1