4-(benzotriazol-1-ylmethyl)-2-methyl-5-nitro-benzotriazole

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-2-methyl-5-nitro-benzotriazole Openeye Name: 4-(benzotriazol-1-ylmethyl)-2-methyl-5-nitro-benzotriazole CAS Name: 4-(1-benzotriazolylmethyl)-2-methyl-5-nitrobenzotriazole IUPAC Name: 4-(benzotriazol-1-ylmethyl)-2-methyl-5-nitrobenzotriazole Traditional Name: 4-(benzotriazol-1-ylmethyl)-2-methyl-5-nitro-benzotriazole Formula: C14H11N7O2 MolecularWeight: 309.28284

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C2C=CC(=C(C2=N1)CN3C4=CC=CC=C4N=N3)[N+](=O)[O-]

Isomeric SMILES

CN1N=C2C=CC(=C(C2=N1)CN3C4=CC=CC=C4N=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N7O2/c1-19-16-11-6-7-12(21(22)23)9(14(11)17-19)8-20-13-5-3-2-4-10(13)15-18-20/h2-7H,8H2,1H3