trimethyl-(4-oxidanylidene-2-tridecanoyloxy-4-tridecoxy-butyl)azanium chloride

Systemtic Name: trimethyl-(4-oxidanylidene-2-tridecanoyloxy-4-tridecoxy-butyl)azanium chloride Openeye Name: trimethyl-(4-oxo-2-tridecanoyloxy-4-tridecoxy-butyl)ammonium chloride CAS Name: trimethyl-[4-oxo-2-(1-oxotridecoxy)-4-tridecoxybutyl]ammonium chloride IUPAC Name: trimethyl-(4-oxo-2-tridecanoyloxy-4-tridecoxybutyl)azanium chloride Traditional Name: (4-keto-2-tridecanoyloxy-4-tridecoxy-butyl)-trimethyl-ammonium chloride Formula: C33H66ClNO4 MolecularWeight: 576.33444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)CC(C[N+](C)(C)C)OC(=O)CCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)CC(C[N+](C)(C)C)OC(=O)CCCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C33H66NO4.ClH/c1-6-8-10-12-14-16-18-20-22-24-26-28-37-33(36)29-31(30-34(3,4)5)38-32(35)27-25-23-21-19-17-15-13-11-9-7-2;/h31H,6-30H2,1-5H3;1H/q+1;/p-1