5-chloranyl-3-nitro-2-oxidanidyl-benzenesulfonate

Systemtic Name: 5-chloranyl-3-nitro-2-oxidanidyl-benzenesulfonate Openeye Name: 5-chloro-3-nitro-2-oxido-benzenesulfonate CAS Name: 5-chloro-3-nitro-2-oxidobenzenesulfonate IUPAC Name: 5-chloro-3-nitro-2-oxidobenzenesulfonate Traditional Name: 5-chloro-3-nitro-2-oxido-besylate Formula: C6H2ClNO6S-2 MolecularWeight: 251.60118

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)[O-])[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)[O-])[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C6H4ClNO6S/c7-3-1-4(8(10)11)6(9)5(2-3)15(12,13)14/h1-2,9H,(H,12,13,14)/p-2