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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C=C(C3=NON=C23)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O5/c1-7-4-2-3-5-8(7)14-11-9(17(19)20)6-10(18(21)22)12-13(11)16-23-15-12/h2-6,14H,1H3