5-methyl-4,6-dinitro-2H-benzotriazole

Systemtic Name: 5-methyl-4,6-dinitro-2H-benzotriazole Openeye Name: 5-methyl-4,6-dinitro-2H-benzotriazole CAS Name: 5-methyl-4,6-dinitro-2H-benzotriazole IUPAC Name: 5-methyl-4,6-dinitro-2H-benzotriazole Traditional Name: 5-methyl-4,6-dinitro-2H-benzotriazole Formula: C7H5N5O4 MolecularWeight: 223.1457

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NNN=C2C=C1[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=NNN=C2C=C1[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H5N5O4/c1-3-5(11(13)14)2-4-6(9-10-8-4)7(3)12(15)16/h2H,1H3,(H,8,9,10)