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methyl sulfate; methyl-tris(11-methyldodecyl)azanium

methyl sulfate; methyl-tris(11-methyldodecyl)azanium

Systemtic Name:methyl sulfate; methyl-tris(11-methyldodecyl)azanium
Openeye Name:methyl sulfate; methyl-tris(11-methyldodecyl)ammonium
CAS Name:methyl sulfate; methyl-tris(11-methyldodecyl)ammonium
IUPAC Name:methyl sulfate; methyl-tris(11-methyldodecyl)azanium
Traditional Name:methyl sulfate; methyl-tris(11-methyldodecyl)ammonium
Formula: C41H87NO4S
MolecularWeight: 690.19878
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C40H84N.CH4O4S/c1-38(2)32-26-20-14-8-11-17-23-29-35-41(7,36-30-24-18-12-9-15-21-27-33-39(3)4)37-31-25-19-13-10-16-22-28-34-40(5)6;1-5-6(2,3)4/h38-40H,8-37H2,1-7H3;1H3,(H,2,3,4)/q+1;/p-1


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