potassium 3-(pyridin-3-ylcarbonylamino)propane-1-sulfonate

Systemtic Name: potassium 3-(pyridin-3-ylcarbonylamino)propane-1-sulfonate Openeye Name: potassium 3-(pyridine-3-carbonylamino)propane-1-sulfonate CAS Name: potassium 3-[[oxo(3-pyridinyl)methyl]amino]-1-propanesulfonate IUPAC Name: potassium 3-(pyridine-3-carbonylamino)propane-1-sulfonate Traditional Name: potassium 3-nicotinamidopropane-1-sulfonate Formula: C9H11KN2O4S MolecularWeight: 282.35794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NCCCS(=O)(=O)[O-].[K+]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NCCCS(=O)(=O)[O-].[K+]

InChI

InChI=1S/C9H12N2O4S.K/c12-9(8-3-1-4-10-7-8)11-5-2-6-16(13,14)15;/h1,3-4,7H,2,5-6H2,(H,11,12)(H,13,14,15);/q;+1/p-1