(2S)-3-(1H-imidazol-3-ium-5-yl)-2-(pyridin-3-ylsulfonylamino)propanoate

Systemtic Name: (2S)-3-(1H-imidazol-3-ium-5-yl)-2-(pyridin-3-ylsulfonylamino)propanoate Openeye Name: (2S)-3-(1H-imidazol-3-ium-5-yl)-2-(3-pyridylsulfonylamino)propanoate CAS Name: (2S)-3-(1H-imidazol-3-ium-5-yl)-2-(3-pyridinylsulfonylamino)propanoate IUPAC Name: (2S)-3-(1H-imidazol-3-ium-5-yl)-2-(pyridin-3-ylsulfonylamino)propanoate Traditional Name: (2S)-3-(1H-imidazol-3-ium-5-yl)-2-(3-pyridylsulfonylamino)propionate Formula: C11H12N4O4S MolecularWeight: 296.30238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)S(=O)(=O)NC(CC2=C[NH+]=CN2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)S(=O)(=O)N[C@@H](CC2=C[NH+]=CN2)C(=O)[O-]

InChI

InChI=1S/C11H12N4O4S/c16-11(17)10(4-8-5-13-7-14-8)15-20(18,19)9-2-1-3-12-6-9/h1-3,5-7,10,15H,4H2,(H,13,14)(H,16,17)/t10-/m0/s1