5,7-dinitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine

Systemtic Name: 5,7-dinitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine Openeye Name: N-benzyl-5,7-dinitro-2,1,3-benzoxadiazol-4-amine CAS Name: 5,7-dinitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine IUPAC Name: N-benzyl-5,7-dinitro-2,1,3-benzoxadiazol-4-amine Traditional Name: benzyl-(5,7-dinitrobenzofurazan-4-yl)amine Formula: C13H9N5O5 MolecularWeight: 315.24106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O5/c19-17(20)9-6-10(18(21)22)12-13(16-23-15-12)11(9)14-7-8-4-2-1-3-5-8/h1-6,14H,7H2