dimethyl 2-nitrobenzene-1,4-disulfonate

Systemtic Name: dimethyl 2-nitrobenzene-1,4-disulfonate Openeye Name: dimethyl 2-nitrobenzene-1,4-disulfonate CAS Name: 2-nitrobenzene-1,4-disulfonic acid dimethyl ester IUPAC Name: dimethyl 2-nitrobenzene-1,4-disulfonate Traditional Name: 2-nitrobenzene-1,4-disulfonic acid dimethyl ester Formula: C8H9NO8S2 MolecularWeight: 311.28896

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COS(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C8H9NO8S2/c1-16-18(12,13)6-3-4-8(19(14,15)17-2)7(5-6)9(10)11/h3-5H,1-2H3