2-[(3,5-dinitropyridin-2-yl)amino]propanoic acid

Systemtic Name: 2-[(3,5-dinitropyridin-2-yl)amino]propanoic acid Openeye Name: 2-[(3,5-dinitro-2-pyridyl)amino]propanoic acid CAS Name: 2-[(3,5-dinitro-2-pyridinyl)amino]propanoic acid IUPAC Name: 2-[(3,5-dinitropyridin-2-yl)amino]propanoic acid Traditional Name: 2-[(3,5-dinitro-2-pyridyl)amino]propionic acid Formula: C8H8N4O6 MolecularWeight: 256.17232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=C(C=C(C=N1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC1=C(C=C(C=N1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H8N4O6/c1-4(8(13)14)10-7-6(12(17)18)2-5(3-9-7)11(15)16/h2-4H,1H3,(H,9,10)(H,13,14)