2-(1-azaniumylpropan-2-yloxy)propylazanium sulfate

Systemtic Name: 2-(1-azaniumylpropan-2-yloxy)propylazanium sulfate Openeye Name: 2-(2-azaniumyl-1-methyl-ethoxy)propylammonium sulfate CAS Name: 2-(1-ammoniopropan-2-yloxy)propylammonium sulfate IUPAC Name: 2-(1-azaniumylpropan-2-yloxy)propylazanium sulfate Traditional Name: 2-(2-ammonio-1-methyl-ethoxy)propylammonium sulfate Formula: C6H18N2O5S MolecularWeight: 230.28252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH3+])OC(C)C[NH3+].[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(C[NH3+])OC(C)C[NH3+].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C6H16N2O.H2O4S/c1-5(3-7)9-6(2)4-8;1-5(2,3)4/h5-6H,3-4,7-8H2,1-2H3;(H2,1,2,3,4)