2-methyl-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]pentanoic acid

Systemtic Name: 2-methyl-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]pentanoic acid Openeye Name: 2-methyl-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]pentanoic acid CAS Name: 2-methyl-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]pentanoic acid IUPAC Name: 2-methyl-2-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]pentanoic acid Traditional Name: 2-methyl-2-[(7-nitrobenzofurazan-4-yl)amino]valeric acid Formula: C12H14N4O5 MolecularWeight: 294.26336

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)O)NC1=CC=C(C2=NON=C12)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)(C(=O)O)NC1=CC=C(C2=NON=C12)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O5/c1-3-6-12(2,11(17)18)13-7-4-5-8(16(19)20)10-9(7)14-21-15-10/h4-5,13H,3,6H2,1-2H3,(H,17,18)