3-oxidanyl-2-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid

Systemtic Name: 3-oxidanyl-2-(pyridin-1-ium-3-ylcarbonylamino)butanoic acid Openeye Name: 3-hydroxy-2-(pyridin-1-ium-3-carbonylamino)butanoic acid CAS Name: 3-hydroxy-2-[[oxo(3-pyridin-1-iumyl)methyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-(pyridin-1-ium-3-carbonylamino)butanoic acid Traditional Name: 3-hydroxy-2-(pyridin-1-ium-3-carbonylamino)butyric acid Formula: C10H13N2O4+ MolecularWeight: 225.22122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=C[NH+]=CC=C1)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=C[NH+]=CC=C1)O

InChI

InChI=1S/C10H12N2O4/c1-6(13)8(10(15)16)12-9(14)7-3-2-4-11-5-7/h2-6,8,13H,1H3,(H,12,14)(H,15,16)/p+1