sodium (4-cyanophenyl)methanesulfonic acid

Systemtic Name: sodium (4-cyanophenyl)methanesulfonic acid Openeye Name: sodium (4-cyanophenyl)methanesulfonic acid CAS Name: sodium (4-cyanophenyl)methanesulfonic acid IUPAC Name: sodium (4-cyanophenyl)methanesulfonic acid Traditional Name: sodium (4-cyanophenyl)methanesulfonic acid Formula: C8H7NNaO3S+ MolecularWeight: 220.20085

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)O)C#N.[Na+]

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)O)C#N.[Na+]

InChI

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