4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]butanoic acid

Systemtic Name: 4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]butanoic acid Openeye Name: 4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]butanoic acid CAS Name: 4-[2-(2-methyl-5-nitro-1-imidazolyl)ethylamino]butanoic acid IUPAC Name: 4-[2-(2-methyl-5-nitroimidazol-1-yl)ethylamino]butanoic acid Traditional Name: 4-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]butyric acid Formula: C10H16N4O4 MolecularWeight: 256.25844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCNCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCNCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H16N4O4/c1-8-12-7-9(14(17)18)13(8)6-5-11-4-2-3-10(15)16/h7,11H,2-6H2,1H3,(H,15,16)