bis(2-hydroxyethyl)-(phenylmethyl)-tridecyl-azanium chloride

Systemtic Name: bis(2-hydroxyethyl)-(phenylmethyl)-tridecyl-azanium chloride Openeye Name: benzyl-bis(2-hydroxyethyl)-tridecyl-ammonium chloride CAS Name: bis(2-hydroxyethyl)-(phenylmethyl)-tridecylammonium chloride IUPAC Name: benzyl-bis(2-hydroxyethyl)-tridecylazanium chloride Traditional Name: benzyl-bis(2-hydroxyethyl)-tridecyl-ammonium chloride Formula: C24H44ClNO2 MolecularWeight: 414.06466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC[N+](CCO)(CCO)CC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C24H44NO2.ClH/c1-2-3-4-5-6-7-8-9-10-11-15-18-25(19-21-26,20-22-27)23-24-16-13-12-14-17-24;/h12-14,16-17,26-27H,2-11,15,18-23H2,1H3;1H/q+1;/p-1