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3-[dimethyl(nonacosyl)azaniumyl]-2-oxidanyl-propane-1-sulfonate

3-[dimethyl(nonacosyl)azaniumyl]-2-oxidanyl-propane-1-sulfonate

Systemtic Name:3-[dimethyl(nonacosyl)azaniumyl]-2-oxidanyl-propane-1-sulfonate
Openeye Name:3-[dimethyl(nonacosyl)ammonio]-2-hydroxy-propane-1-sulfonate
CAS Name:3-[dimethyl(nonacosyl)ammonio]-2-hydroxy-1-propanesulfonate
IUPAC Name:3-[dimethyl(nonacosyl)azaniumyl]-2-hydroxypropane-1-sulfonate
Traditional Name:3-[dimethyl(nonacosyl)ammonio]-2-hydroxy-propane-1-sulfonate
Formula: C34H71NO4S
MolecularWeight: 589.99684
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC(CS(=O)(=O)[O-])O


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC[N+](C)(C)CC(CS(=O)(=O)[O-])O


InChI

InChI=1S/C34H71NO4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-35(2,3)32-34(36)33-40(37,38)39/h34,36H,4-33H2,1-3H3


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