hexadecyl(trimethyl)azanium carbonate

Systemtic Name: hexadecyl(trimethyl)azanium carbonate Openeye Name: hexadecyl(trimethyl)ammonium carbonate CAS Name: hexadecyl(trimethyl)ammonium carbonate IUPAC Name: hexadecyl(trimethyl)azanium carbonate Traditional Name: cetyl(trimethyl)ammonium carbonate Formula: C39H84N2O3 MolecularWeight: 629.09586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C19H42N.CH2O3/c2*1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;2-1(3)4/h2*5-19H2,1-4H3;(H2,2,3,4)/q2*+1;/p-2