dimethyl(dioctadecyl)azanium; methanesulfonic acid

Systemtic Name: dimethyl(dioctadecyl)azanium; methanesulfonic acid Openeye Name: dimethyl(dioctadecyl)ammonium; methanesulfonic acid CAS Name: dimethyl(dioctadecyl)ammonium; methanesulfonic acid IUPAC Name: dimethyl(dioctadecyl)azanium; methanesulfonic acid Traditional Name: dimethyl(distearyl)ammonium; mesylic acid Formula: C39H84NO3S+ MolecularWeight: 647.15416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.CS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCCCC.CS(=O)(=O)O

InChI

InChI=1S/C38H80N.CH4O3S/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-5(2,3)4/h5-38H2,1-4H3;1H3,(H,2,3,4)/q+1;