hydrogen sulfate; 2-methyl-3,4,5,6-tetranitro-benzenediazonium

Systemtic Name: hydrogen sulfate; 2-methyl-3,4,5,6-tetranitro-benzenediazonium Openeye Name: hydrogen sulfate; 2-methyl-3,4,5,6-tetranitro-benzenediazonium CAS Name: hydrogen sulfate; 2-methyl-3,4,5,6-tetranitrobenzenediazonium IUPAC Name: hydrogen sulfate; 2-methyl-3,4,5,6-tetranitrobenzenediazonium Traditional Name: 2-methyl-3,4,5,6-tetranitro-benzenediazonium bisulfate Formula: C7H4N6O12S MolecularWeight: 396.20466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H3N6O8.H2O4S/c1-2-3(9-8)5(11(16)17)7(13(20)21)6(12(18)19)4(2)10(14)15;1-5(2,3)4/h1H3;(H2,1,2,3,4)/q+1;/p-1