2-(pyridin-3-ylcarbonylamino)ethanesulfonate

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethanesulfonate Openeye Name: 2-(pyridine-3-carbonylamino)ethanesulfonate CAS Name: 2-[[oxo(3-pyridinyl)methyl]amino]ethanesulfonate IUPAC Name: 2-(pyridine-3-carbonylamino)ethanesulfonate Traditional Name: 2-nicotinamidoethanesulfonate Formula: C8H9N2O4S- MolecularWeight: 229.23306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NCCS(=O)(=O)[O-]

InChI

InChI=1S/C8H10N2O4S/c11-8(7-2-1-3-9-6-7)10-4-5-15(12,13)14/h1-3,6H,4-5H2,(H,10,11)(H,12,13,14)/p-1