(4-methanoylphenyl) 2-chloranyl-5-nitro-benzenesulfonate

Systemtic Name: (4-methanoylphenyl) 2-chloranyl-5-nitro-benzenesulfonate Openeye Name: (4-formylphenyl) 2-chloro-5-nitro-benzenesulfonate CAS Name: 2-chloro-5-nitrobenzenesulfonic acid (4-formylphenyl) ester IUPAC Name: (4-formylphenyl) 2-chloro-5-nitrobenzenesulfonate Traditional Name: 2-chloro-5-nitro-benzenesulfonic acid (4-formylphenyl) ester Formula: C13H8ClNO6S MolecularWeight: 341.72372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H8ClNO6S/c14-12-6-3-10(15(17)18)7-13(12)22(19,20)21-11-4-1-9(8-16)2-5-11/h1-8H