(6-nitrobenzotriazol-1-yl) methanesulfonate

Systemtic Name: (6-nitrobenzotriazol-1-yl) methanesulfonate Openeye Name: (6-nitrobenzotriazol-1-yl) methanesulfonate CAS Name: methanesulfonic acid (6-nitro-1-benzotriazolyl) ester IUPAC Name: (6-nitrobenzotriazol-1-yl) methanesulfonate Traditional Name: methanesulfonic acid (6-nitrobenzotriazol-1-yl) ester Formula: C7H6N4O5S MolecularWeight: 258.21134

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)ON1C2=C(C=CC(=C2)[N+](=O)[O-])N=N1

Isomeric SMILES

CS(=O)(=O)ON1C2=C(C=CC(=C2)[N+](=O)[O-])N=N1

InChI

InChI=1S/C7H6N4O5S/c1-17(14,15)16-10-7-4-5(11(12)13)2-3-6(7)8-9-10/h2-4H,1H3