1-butan-2-yl-5,6-dimethyl-7-nitro-benzotriazole

Systemtic Name: 1-butan-2-yl-5,6-dimethyl-7-nitro-benzotriazole Openeye Name: 5,6-dimethyl-7-nitro-1-sec-butyl-benzotriazole CAS Name: 1-butan-2-yl-5,6-dimethyl-7-nitrobenzotriazole IUPAC Name: 1-butan-2-yl-5,6-dimethyl-7-nitrobenzotriazole Traditional Name: 5,6-dimethyl-7-nitro-1-sec-butyl-benzotriazole Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C(=C2[N+](=O)[O-])C)C)N=N1

Isomeric SMILES

CCC(C)N1C2=C(C=C(C(=C2[N+](=O)[O-])C)C)N=N1

InChI

InChI=1S/C12H16N4O2/c1-5-8(3)15-12-10(13-14-15)6-7(2)9(4)11(12)16(17)18/h6,8H,5H2,1-4H3