2-[3-(4-nitroimidazol-1-yl)propanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[3-(4-nitroimidazol-1-yl)propanoylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[3-(4-nitroimidazol-1-yl)propanoylamino]propanoic acid CAS Name: 3-hydroxy-2-[[3-(4-nitro-1-imidazolyl)-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[3-(4-nitroimidazol-1-yl)propanoylamino]propanoic acid Traditional Name: 3-hydroxy-2-[3-(4-nitroimidazol-1-yl)propanoylamino]propionic acid Formula: C9H12N4O6 MolecularWeight: 272.21478

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=CN1CCC(=O)NC(CO)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(N=CN1CCC(=O)NC(CO)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H12N4O6/c14-4-6(9(16)17)11-8(15)1-2-12-3-7(10-5-12)13(18)19/h3,5-6,14H,1-2,4H2,(H,11,15)(H,16,17)