3-[(3-nitropyridin-1-ium-2-yl)amino]propanoate

Systemtic Name: 3-[(3-nitropyridin-1-ium-2-yl)amino]propanoate Openeye Name: 3-[(3-nitropyridin-1-ium-2-yl)amino]propanoate CAS Name: 3-[(3-nitro-2-pyridin-1-iumyl)amino]propanoate IUPAC Name: 3-[(3-nitropyridin-1-ium-2-yl)amino]propanoate Traditional Name: 3-[(3-nitropyridin-1-ium-2-yl)amino]propionate Formula: C8H9N3O4 MolecularWeight: 211.17476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9N3O4/c12-7(13)3-5-10-8-6(11(14)15)2-1-4-9-8/h1-2,4H,3,5H2,(H,9,10)(H,12,13)