dimethyl-bis(1-tricosa-10,12-diynoyloxyethyl)azanium chloride

Systemtic Name: dimethyl-bis(1-tricosa-10,12-diynoyloxyethyl)azanium chloride Openeye Name: dimethyl-bis(1-tricosa-10,12-diynoyloxyethyl)ammonium chloride CAS Name: dimethyl-bis[1-(1-oxotricosa-10,12-diynoxy)ethyl]ammonium chloride IUPAC Name: dimethyl-bis(1-tricosa-10,12-diynoyloxyethyl)azanium chloride Traditional Name: dimethyl-bis(1-tricosa-10,12-diynoyloxyethyl)ammonium chloride Formula: C52H88ClNO4 MolecularWeight: 826.71242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC#CCCCCCCCCC(=O)OC(C)[N+](C)(C)C(C)OC(=O)CCCCCCCCC#CC#CCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCC#CC#CCCCCCCCCC(=O)OC(C)[N+](C)(C)C(C)OC(=O)CCCCCCCCC#CC#CCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C52H88NO4.ClH/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-51(54)56-49(3)53(5,6)50(4)57-52(55)48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;/h49-50H,7-24,33-48H2,1-6H3;1H/q+1;/p-1