1,4-bis(4-bromanyl-2,3,5,6-tetradeuterio-phenyl)butane-1,4-dione

Systemtic Name: 1,4-bis(4-bromanyl-2,3,5,6-tetradeuterio-phenyl)butane-1,4-dione Openeye Name: 1,4-bis(4-bromo-2,3,5,6-tetradeuterio-phenyl)butane-1,4-dione CAS Name: 1,4-bis(4-bromo-2,3,5,6-tetradeuteriophenyl)butane-1,4-dione IUPAC Name: 1,4-bis(4-bromo-2,3,5,6-tetradeuteriophenyl)butane-1,4-dione Traditional Name: 1,4-bis(4-bromo-2,3,5,6-tetradeuterio-phenyl)butane-1,4-dione Formula: C16H12Br2O2 MolecularWeight: 404.122574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCC(=O)C2=CC=C(C=C2)Br)Br

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1C(=O)CCC(=O)C2=C(C(=C(C(=C2[2H])[2H])Br)[2H])[2H])[2H])[2H])Br)[2H]

InChI

InChI=1S/C16H12Br2O2/c17-13-5-1-11(2-6-13)15(19)9-10-16(20)12-3-7-14(18)8-4-12/h1-8H,9-10H2/i1D,2D,3D,4D,5D,6D,7D,8D