sodium benzenesulfonic acid thiocyanate

Systemtic Name: sodium benzenesulfonic acid thiocyanate Openeye Name: sodium benzenesulfonic acid thiocyanate CAS Name: sodium benzenesulfonic acid thiocyanate IUPAC Name: sodium benzenesulfonic acid thiocyanate Traditional Name: sodium besylic acid thiocyanate Formula: C7H5NNaO3S2- MolecularWeight: 238.23927

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=[C-]1)S(=O)(=O)O.C(#N)[S-].[Na+]

Isomeric SMILES

C1=CC(=CC=[C-]1)S(=O)(=O)O.C(#N)[S-].[Na+]

InChI

InChI=1S/C6H5O3S.CHNS.Na/c7-10(8,9)6-4-2-1-3-5-6;2-1-3;/h2-5H,(H,7,8,9);3H;/q-1;;+1/p-1