4,7-dinitroso-2-phenyl-1,3,5,6-tetrahydrobenzotriazole

Systemtic Name: 4,7-dinitroso-2-phenyl-1,3,5,6-tetrahydrobenzotriazole Openeye Name: 4,7-dinitroso-2-phenyl-1,3,5,6-tetrahydrobenzotriazole CAS Name: 4,7-dinitroso-2-phenyl-1,3,5,6-tetrahydrobenzotriazole IUPAC Name: 4,7-dinitroso-2-phenyl-1,3,5,6-tetrahydrobenzotriazole Traditional Name: 4,7-dinitroso-2-phenyl-1,3,5,6-tetrahydrobenzotriazole Formula: C12H11N5O2 MolecularWeight: 257.24804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C2C(=C1N=O)NN(N2)C3=CC=CC=C3)N=O

Isomeric SMILES

C1CC(=C2C(=C1N=O)NN(N2)C3=CC=CC=C3)N=O

InChI

InChI=1S/C12H11N5O2/c18-15-9-6-7-10(16-19)12-11(9)13-17(14-12)8-4-2-1-3-5-8/h1-5,13-14H,6-7H2