3-[bis(2-hydroxyethyl)-octadecyl-azaniumyl]-2-oxidanyl-propane-1-sulfonate

Systemtic Name: 3-[bis(2-hydroxyethyl)-octadecyl-azaniumyl]-2-oxidanyl-propane-1-sulfonate Openeye Name: 3-[bis(2-hydroxyethyl)-octadecyl-ammonio]-2-hydroxy-propane-1-sulfonate CAS Name: 3-[bis(2-hydroxyethyl)-octadecylammonio]-2-hydroxy-1-propanesulfonate IUPAC Name: 3-[bis(2-hydroxyethyl)-octadecylazaniumyl]-2-hydroxypropane-1-sulfonate Traditional Name: 3-[bis(2-hydroxyethyl)-stearyl-ammonio]-2-hydroxy-propane-1-sulfonate Formula: C25H53NO6S MolecularWeight: 495.75642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CC(CS(=O)(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CC(CS(=O)(=O)[O-])O

InChI

InChI=1S/C25H53NO6S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(19-21-27,20-22-28)23-25(29)24-33(30,31)32/h25,27-29H,2-24H2,1H3