5-cyano-2-methanoyl-benzenesulfonic acid

Systemtic Name: 5-cyano-2-methanoyl-benzenesulfonic acid Openeye Name: 5-cyano-2-formyl-benzenesulfonic acid CAS Name: 5-cyano-2-formylbenzenesulfonic acid IUPAC Name: 5-cyano-2-formylbenzenesulfonic acid Traditional Name: 5-cyano-2-formyl-besylic acid Formula: C8H5NO4S MolecularWeight: 211.1946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)S(=O)(=O)O)C=O

Isomeric SMILES

C1=CC(=C(C=C1C#N)S(=O)(=O)O)C=O

InChI

InChI=1S/C8H5NO4S/c9-4-6-1-2-7(5-10)8(3-6)14(11,12)13/h1-3,5H,(H,11,12,13)