3-[(5-oxidanylpyridin-1-ium-3-yl)carbonylamino]propanoate

Systemtic Name: 3-[(5-oxidanylpyridin-1-ium-3-yl)carbonylamino]propanoate Openeye Name: 3-[(5-hydroxypyridin-1-ium-3-carbonyl)amino]propanoate CAS Name: 3-[[(5-hydroxy-3-pyridin-1-iumyl)-oxomethyl]amino]propanoate IUPAC Name: 3-[(5-hydroxypyridin-1-ium-3-carbonyl)amino]propanoate Traditional Name: 3-[(5-hydroxypyridin-1-ium-3-carbonyl)amino]propionate Formula: C9H10N2O4 MolecularWeight: 210.1867

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=[NH+]C=C1O)C(=O)NCCC(=O)[O-]

Isomeric SMILES

C1=C(C=[NH+]C=C1O)C(=O)NCCC(=O)[O-]

InChI

InChI=1S/C9H10N2O4/c12-7-3-6(4-10-5-7)9(15)11-2-1-8(13)14/h3-5,12H,1-2H2,(H,11,15)(H,13,14)