6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid

Systemtic Name: 6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid Openeye Name: 6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid CAS Name: 6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid IUPAC Name: 6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoic acid Traditional Name: 6-[(7-nitrobenzofurazan-4-yl)amino]hexanoic acid Formula: C12H14N4O5 MolecularWeight: 294.26336

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])NCCCCCC(=O)O

Isomeric SMILES

C1=C(C2=NON=C2C(=C1)[N+](=O)[O-])NCCCCCC(=O)O

InChI

InChI=1S/C12H14N4O5/c17-10(18)4-2-1-3-7-13-8-5-6-9(16(19)20)12-11(8)14-21-15-12/h5-6,13H,1-4,7H2,(H,17,18)