4,4-dimethyl-3-oxidanylidene-N-[4,5,6,7-tetrakis(bromanyl)benzotriazol-2-yl]pentanamide

Systemtic Name: 4,4-dimethyl-3-oxidanylidene-N-[4,5,6,7-tetrakis(bromanyl)benzotriazol-2-yl]pentanamide Openeye Name: 4,4-dimethyl-3-oxo-N-(4,5,6,7-tetrabromobenzotriazol-2-yl)pentanamide CAS Name: 4,4-dimethyl-3-oxo-N-(4,5,6,7-tetrabromo-2-benzotriazolyl)pentanamide IUPAC Name: 4,4-dimethyl-3-oxo-N-(4,5,6,7-tetrabromobenzotriazol-2-yl)pentanamide Traditional Name: 3-keto-4,4-dimethyl-N-(4,5,6,7-tetrabromobenzotriazol-2-yl)valeramide Formula: C13H12Br4N4O2 MolecularWeight: 575.87598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(=O)NN1N=C2C(=C(C(=C(C2=N1)Br)Br)Br)Br

Isomeric SMILES

CC(C)(C)C(=O)CC(=O)NN1N=C2C(=C(C(=C(C2=N1)Br)Br)Br)Br

InChI

InChI=1S/C13H12Br4N4O2/c1-13(2,3)5(22)4-6(23)18-21-19-11-9(16)7(14)8(15)10(17)12(11)20-21/h4H2,1-3H3,(H,18,23)