dimethyl-(3-oxidanylidene-1-tetradecoxy-tetradecan-2-yl)-propyl-azanium chloride

Systemtic Name: dimethyl-(3-oxidanylidene-1-tetradecoxy-tetradecan-2-yl)-propyl-azanium chloride Openeye Name: dimethyl-[2-oxo-1-(tetradecoxymethyl)tridecyl]-propyl-ammonium chloride CAS Name: dimethyl-(3-oxo-1-tetradecoxytetradecan-2-yl)-propylammonium chloride IUPAC Name: dimethyl-(3-oxo-1-tetradecoxytetradecan-2-yl)-propylazanium chloride Traditional Name: [2-keto-1-(myristyloxymethyl)tridecyl]-dimethyl-propyl-ammonium chloride Formula: C33H68ClNO2 MolecularWeight: 546.35152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOCC(C(=O)CCCCCCCCCCC)[N+](C)(C)CCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCOCC(C(=O)CCCCCCCCCCC)[N+](C)(C)CCC.[Cl-]

InChI

InChI=1S/C33H68NO2.ClH/c1-6-9-11-13-15-17-18-19-21-23-25-27-30-36-31-32(34(4,5)29-8-3)33(35)28-26-24-22-20-16-14-12-10-7-2;/h32H,6-31H2,1-5H3;1H/q+1;/p-1