2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]propanoic acid

Systemtic Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]propanoic acid Openeye Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]propanoic acid CAS Name: 2-[2-(2-methyl-5-nitro-1-imidazolyl)ethylamino]propanoic acid IUPAC Name: 2-[2-(2-methyl-5-nitroimidazol-1-yl)ethylamino]propanoic acid Traditional Name: 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]propionic acid Formula: C9H14N4O4 MolecularWeight: 242.23186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCNC(C)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCNC(C)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H14N4O4/c1-6(9(14)15)10-3-4-12-7(2)11-5-8(12)13(16)17/h5-6,10H,3-4H2,1-2H3,(H,14,15)