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

Systemtic Name: 2-methyl-2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]pentanoic acid Openeye Name: 2-methyl-2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]pentanoic acid CAS Name: 2-methyl-2-[2-(2-methyl-5-nitro-1-imidazolyl)ethylamino]pentanoic acid IUPAC Name: 2-methyl-2-[2-(2-methyl-5-nitroimidazol-1-yl)ethylamino]pentanoic acid Traditional Name: 2-methyl-2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethylamino]valeric acid Formula: C12H20N4O4 MolecularWeight: 284.3116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NCCN1C(=NC=C1[N+](=O)[O-])C

Isomeric SMILES

CCCC(C)(C(=O)O)NCCN1C(=NC=C1[N+](=O)[O-])C

InChI

InChI=1S/C12H20N4O4/c1-4-5-12(3,11(17)18)14-6-7-15-9(2)13-8-10(15)16(19)20/h8,14H,4-7H2,1-3H3,(H,17,18)