2-(cyanomethyl)benzenesulfonic acid; potassium

Systemtic Name: 2-(cyanomethyl)benzenesulfonic acid; potassium Openeye Name: 2-(cyanomethyl)benzenesulfonic acid; potassium CAS Name: 2-(cyanomethyl)benzenesulfonic acid; potassium IUPAC Name: 2-(cyanomethyl)benzenesulfonic acid; potassium Traditional Name: 2-(cyanomethyl)besylic acid; potassium Formula: C8H7KNO3S MolecularWeight: 236.30938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC#N)S(=O)(=O)O.[K]

Isomeric SMILES

C1=CC=C(C(=C1)CC#N)S(=O)(=O)O.[K]

InChI

InChI=1S/C8H7NO3S.K/c9-6-5-7-3-1-2-4-8(7)13(10,11)12;/h1-4H,5H2,(H,10,11,12);