7,8-bis(bromanyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-one

Systemtic Name: 7,8-bis(bromanyl)-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-one Openeye Name: 7,8-dibromo-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-one CAS Name: 7,8-dibromo-2,2-dimethyl-4-(1,2,4-triazol-1-yl)-3-octanone IUPAC Name: 7,8-dibromo-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-one Traditional Name: 7,8-dibromo-2,2-dimethyl-4-(1,2,4-triazol-1-yl)octan-3-one Formula: C12H19Br2N3O MolecularWeight: 381.10676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CCC(CBr)Br)N1C=NC=N1

Isomeric SMILES

CC(C)(C)C(=O)C(CCC(CBr)Br)N1C=NC=N1

InChI

InChI=1S/C12H19Br2N3O/c1-12(2,3)11(18)10(5-4-9(14)6-13)17-8-15-7-16-17/h7-10H,4-6H2,1-3H3