2-azanyl-3-methyl-4,5-dinitro-pentanoic acid

Systemtic Name: 2-azanyl-3-methyl-4,5-dinitro-pentanoic acid Openeye Name: 2-amino-3-methyl-4,5-dinitro-pentanoic acid CAS Name: 2-amino-3-methyl-4,5-dinitropentanoic acid IUPAC Name: 2-amino-3-methyl-4,5-dinitropentanoic acid Traditional Name: 2-amino-3-methyl-4,5-dinitro-valeric acid Formula: C6H11N3O6 MolecularWeight: 221.16804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H11N3O6/c1-3(5(7)6(10)11)4(9(14)15)2-8(12)13/h3-5H,2,7H2,1H3,(H,10,11)