4-pyridin-4-ylcarbonylbenzenesulfinic acid

Systemtic Name: 4-pyridin-4-ylcarbonylbenzenesulfinic acid Openeye Name: 4-(pyridine-4-carbonyl)benzenesulfinic acid CAS Name: 4-[oxo(pyridin-4-yl)methyl]benzenesulfinic acid IUPAC Name: 4-(pyridine-4-carbonyl)benzenesulfinic acid Traditional Name: 4-isonicotinoylbenzenesulfinic acid Formula: C12H9NO3S MolecularWeight: 247.26976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC=NC=C2)S(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC=NC=C2)S(=O)O

InChI

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