didecyl(dimethyl)azanium; hydrogen carbonate; carbonate

Systemtic Name: didecyl(dimethyl)azanium; hydrogen carbonate; carbonate Openeye Name: didecyl(dimethyl)ammonium; hydrogen carbonate; carbonate CAS Name: didecyl(dimethyl)ammonium; hydrogen carbonate; carbonate IUPAC Name: didecyl(dimethyl)azanium; hydrogen carbonate; carbonate Traditional Name: didecyl(dimethyl)ammonium bicarbonate carbonate Formula: C68H145N3O6 MolecularWeight: 1100.8954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.C(=O)(O)[O-].C(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.C(=O)(O)[O-].C(=O)([O-])[O-]

InChI

InChI=1S/3C22H48N.2CH2O3/c3*1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;2*2-1(3)4/h3*5-22H2,1-4H3;2*(H2,2,3,4)/q3*+1;;/p-3