3-[dimethylamino(phenylcarbonyl)amino]propyl-dimethyl-octadecyl-azanium

Systemtic Name: 3-[dimethylamino(phenylcarbonyl)amino]propyl-dimethyl-octadecyl-azanium Openeye Name: 3-[benzoyl(dimethylamino)amino]propyl-dimethyl-octadecyl-ammonium CAS Name: 3-[benzoyl(dimethylamino)amino]propyl-dimethyl-octadecylammonium IUPAC Name: 3-[benzoyl(dimethylamino)amino]propyl-dimethyl-octadecylazanium Traditional Name: 3-[benzoyl(dimethylamino)amino]propyl-dimethyl-stearyl-ammonium Formula: C32H60N3O+ MolecularWeight: 502.8383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCN(C(=O)C1=CC=CC=C1)N(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCN(C(=O)C1=CC=CC=C1)N(C)C

InChI

InChI=1S/C32H60N3O/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-29-35(4,5)30-25-28-34(33(2)3)32(36)31-26-22-21-23-27-31/h21-23,26-27H,6-20,24-25,28-30H2,1-5H3/q+1