didodecyl(methyl)azanium; 2-ethylhexanedioic acid; dichloride

Systemtic Name: didodecyl(methyl)azanium; 2-ethylhexanedioic acid; dichloride Openeye Name: didodecyl(methyl)ammonium; 2-ethylhexanedioic acid; dichloride CAS Name: didodecyl(methyl)ammonium; 2-ethylhexanedioic acid; dichloride IUPAC Name: didodecyl(methyl)azanium; 2-ethylhexanedioic acid; dichloride Traditional Name: dilauryl(methyl)ammonium; 2-ethyladipic acid; dichloride Formula: C58H122Cl2N2O4 MolecularWeight: 982.50628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH+](C)CCCCCCCCCCCC.CCCCCCCCCCCC[NH+](C)CCCCCCCCCCCC.CCC(CCCC(=O)O)C(=O)O.[Cl-].[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[NH+](C)CCCCCCCCCCCC.CCCCCCCCCCCC[NH+](C)CCCCCCCCCCCC.CCC(CCCC(=O)O)C(=O)O.[Cl-].[Cl-]

InChI

InChI=1S/2C25H53N.C8H14O4.2ClH/c2*1-4-6-8-10-12-14-16-18-20-22-24-26(3)25-23-21-19-17-15-13-11-9-7-5-2;1-2-6(8(11)12)4-3-5-7(9)10;;/h2*4-25H2,1-3H3;6H,2-5H2,1H3,(H,9,10)(H,11,12);2*1H