hydrogen sulfate; 1,4,7,10-tetrazoniacyclotridecane

Systemtic Name: hydrogen sulfate; 1,4,7,10-tetrazoniacyclotridecane Openeye Name: hydrogen sulfate; 1,4,7,10-tetrazoniacyclotridecane CAS Name: hydrogen sulfate; 1,4,7,10-tetrazoniacyclotridecane IUPAC Name: hydrogen sulfate; 1,4,7,10-tetrazoniacyclotridecane Traditional Name: 1,4,7,10-tetrazoniacyclotridecane tetrabisulfate Formula: C9H30N4O16S4 MolecularWeight: 578.6117

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC[NH2+]CC[NH2+]CC[NH2+]C1.OS(=O)(=O)[O-].OS(=O)(=O)[O-].OS(=O)(=O)[O-].OS(=O)(=O)[O-]

Isomeric SMILES

C1C[NH2+]CC[NH2+]CC[NH2+]CC[NH2+]C1.OS(=O)(=O)[O-].OS(=O)(=O)[O-].OS(=O)(=O)[O-].OS(=O)(=O)[O-]

InChI

InChI=1S/C9H22N4.4H2O4S/c1-2-10-4-6-12-8-9-13-7-5-11-3-1;4*1-5(2,3)4/h10-13H,1-9H2;4*(H2,1,2,3,4)