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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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