sodium 4-pyridin-4-ylcarbonylbenzenesulfinate

Systemtic Name: sodium 4-pyridin-4-ylcarbonylbenzenesulfinate Openeye Name: sodium 4-(pyridine-4-carbonyl)benzenesulfinate CAS Name: sodium 4-[oxo(pyridin-4-yl)methyl]benzenesulfinate IUPAC Name: sodium 4-(pyridine-4-carbonyl)benzenesulfinate Traditional Name: sodium 4-isonicotinoylbenzenesulfinate Formula: C12H8NNaO3S MolecularWeight: 269.25159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC=NC=C2)S(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC=NC=C2)S(=O)[O-].[Na+]

InChI

InChI=1S/C12H9NO3S.Na/c14-12(10-5-7-13-8-6-10)9-1-3-11(4-2-9)17(15)16;/h1-8H,(H,15,16);/q;+1/p-1