2-(4-azanylpyridin-1-ium-1-yl)ethanesulfonate

Systemtic Name: 2-(4-azanylpyridin-1-ium-1-yl)ethanesulfonate Openeye Name: 2-(4-aminopyridin-1-ium-1-yl)ethanesulfonate CAS Name: 2-(4-amino-1-pyridin-1-iumyl)ethanesulfonate IUPAC Name: 2-(4-aminopyridin-1-ium-1-yl)ethanesulfonate Traditional Name: 2-(4-aminopyridin-1-ium-1-yl)ethanesulfonate Formula: C7H10N2O3S MolecularWeight: 202.2309

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1N)CCS(=O)(=O)[O-]

Isomeric SMILES

C1=C[N+](=CC=C1N)CCS(=O)(=O)[O-]

InChI

InChI=1S/C7H10N2O3S/c8-7-1-3-9(4-2-7)5-6-13(10,11)12/h1-4,8H,5-6H2,(H,10,11,12)