N-(2,6-dimethylphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine

Systemtic Name: N-(2,6-dimethylphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine Openeye Name: N-(2,6-dimethylphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine CAS Name: N-(2,6-dimethylphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine IUPAC Name: N-(2,6-dimethylphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine Traditional Name: (2,6-dimethylphenyl)-(4-nitrobenzofurazan-5-yl)amine Formula: C14H12N4O3 MolecularWeight: 284.27008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=C(C3=NON=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=C(C3=NON=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H12N4O3/c1-8-4-3-5-9(2)12(8)15-11-7-6-10-13(17-21-16-10)14(11)18(19)20/h3-7,15H,1-2H3