3-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]phenol

Systemtic Name: 3-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]phenol Openeye Name: 3-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]phenol CAS Name: 3-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]phenol IUPAC Name: 3-[(5,7-dinitro-2,1,3-benzoxadiazol-4-yl)amino]phenol Traditional Name: 3-[(5,7-dinitrobenzofurazan-4-yl)amino]phenol Formula: C12H7N5O6 MolecularWeight: 317.21388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)O)NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H7N5O6/c18-7-3-1-2-6(4-7)13-10-8(16(19)20)5-9(17(21)22)11-12(10)15-23-14-11/h1-5,13,18H