(3-butoxy-2-oxidanyl-propyl)-dimethyl-(2-oxidanyl-3-sulfo-propyl)azanium

Systemtic Name: (3-butoxy-2-oxidanyl-propyl)-dimethyl-(2-oxidanyl-3-sulfo-propyl)azanium Openeye Name: (3-butoxy-2-hydroxy-propyl)-(2-hydroxy-3-sulfo-propyl)-dimethyl-ammonium CAS Name: (3-butoxy-2-hydroxypropyl)-(2-hydroxy-3-sulfopropyl)-dimethylammonium IUPAC Name: (3-butoxy-2-hydroxypropyl)-(2-hydroxy-3-sulfopropyl)-dimethylazanium Traditional Name: (3-butoxy-2-hydroxy-propyl)-(2-hydroxy-3-sulfo-propyl)-dimethyl-ammonium Formula: C12H28NO6S+ MolecularWeight: 314.41882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C[N+](C)(C)CC(CS(=O)(=O)O)O)O

Isomeric SMILES

CCCCOCC(C[N+](C)(C)CC(CS(=O)(=O)O)O)O

InChI

InChI=1S/C12H27NO6S/c1-4-5-6-19-9-11(14)7-13(2,3)8-12(15)10-20(16,17)18/h11-12,14-15H,4-10H2,1-3H3/p+1