hydrogen sulfate; 4-methyl-2,6-dinitro-benzenediazonium

Systemtic Name: hydrogen sulfate; 4-methyl-2,6-dinitro-benzenediazonium Openeye Name: hydrogen sulfate; 4-methyl-2,6-dinitro-benzenediazonium CAS Name: hydrogen sulfate; 4-methyl-2,6-dinitrobenzenediazonium IUPAC Name: hydrogen sulfate; 4-methyl-2,6-dinitrobenzenediazonium Traditional Name: 4-methyl-2,6-dinitro-benzenediazonium bisulfate Formula: C7H6N4O8S MolecularWeight: 306.20954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])[N+]#N)[N+](=O)[O-].OS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])[N+]#N)[N+](=O)[O-].OS(=O)(=O)[O-]

InChI

InChI=1S/C7H5N4O4.H2O4S/c1-4-2-5(10(12)13)7(9-8)6(3-4)11(14)15;1-5(2,3)4/h2-3H,1H3;(H2,1,2,3,4)/q+1;/p-1