3-(pyridin-3-ylcarbonylamino)benzenesulfonic acid

Systemtic Name: 3-(pyridin-3-ylcarbonylamino)benzenesulfonic acid Openeye Name: 3-(pyridine-3-carbonylamino)benzenesulfonic acid CAS Name: 3-[[oxo(3-pyridinyl)methyl]amino]benzenesulfonic acid IUPAC Name: 3-(pyridine-3-carbonylamino)benzenesulfonic acid Traditional Name: 3-nicotinamidobesylic acid Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O4S/c15-12(9-3-2-6-13-8-9)14-10-4-1-5-11(7-10)19(16,17)18/h1-8H,(H,14,15)(H,16,17,18)