(4-methanoylphenyl) 2,4-dinitrobenzenesulfonate

Systemtic Name: (4-methanoylphenyl) 2,4-dinitrobenzenesulfonate Openeye Name: (4-formylphenyl) 2,4-dinitrobenzenesulfonate CAS Name: 2,4-dinitrobenzenesulfonic acid (4-formylphenyl) ester IUPAC Name: (4-formylphenyl) 2,4-dinitrobenzenesulfonate Traditional Name: 2,4-dinitrobenzenesulfonic acid (4-formylphenyl) ester Formula: C13H8N2O8S MolecularWeight: 352.27622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=O)OS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=O)OS(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8N2O8S/c16-8-9-1-4-11(5-2-9)23-24(21,22)13-6-3-10(14(17)18)7-12(13)15(19)20/h1-8H