hydrogen sulfate; 1,4,7-trimethyl-1,4,7-triazonan-1-ium

Systemtic Name: hydrogen sulfate; 1,4,7-trimethyl-1,4,7-triazonan-1-ium Openeye Name: hydrogen sulfate; 1,4,7-trimethyl-1,4,7-triazonan-1-ium CAS Name: hydrogen sulfate; 1,4,7-trimethyl-1,4,7-triazonan-1-ium IUPAC Name: hydrogen sulfate; 1,4,7-trimethyl-1,4,7-triazonan-1-ium Traditional Name: 1,4,7-trimethyl-1,4,7-triazonan-1-ium bisulfate Formula: C9H23N3O4S MolecularWeight: 269.36162

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CCN(CC1)C)C.OS(=O)(=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CCN(CC1)C)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C9H21N3.H2O4S/c1-10-4-6-11(2)8-9-12(3)7-5-10;1-5(2,3)4/h4-9H2,1-3H3;(H2,1,2,3,4)