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methyl-dioctadecyl-(3-sulfopropyl)azanium

methyl-dioctadecyl-(3-sulfopropyl)azanium

Systemtic Name:methyl-dioctadecyl-(3-sulfopropyl)azanium
Openeye Name:methyl-dioctadecyl-(3-sulfopropyl)ammonium
CAS Name:methyl-dioctadecyl-(3-sulfopropyl)ammonium
IUPAC Name:methyl-dioctadecyl-(3-sulfopropyl)azanium
Traditional Name:methyl-distearyl-(3-sulfopropyl)ammonium
Formula: C40H84NO3S+
MolecularWeight: 659.16486
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCCCC)CCCS(=O)(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCCCC)CCCS(=O)(=O)O


InChI

InChI=1S/C40H83NO3S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-37-41(3,39-36-40-45(42,43)44)38-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h4-40H2,1-3H3/p+1


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