[2,6-bis(bromanyl)-4-ethynyl-phenyl]-(4-tert-butyl-2,6-dimethyl-phenyl)methanone

Systemtic Name: [2,6-bis(bromanyl)-4-ethynyl-phenyl]-(4-tert-butyl-2,6-dimethyl-phenyl)methanone Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)-(2,6-dibromo-4-ethynyl-phenyl)methanone CAS Name: (4-tert-butyl-2,6-dimethylphenyl)-(2,6-dibromo-4-ethynylphenyl)methanone IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)-(2,6-dibromo-4-ethynylphenyl)methanone Traditional Name: (4-tert-butyl-2,6-dimethyl-phenyl)-(2,6-dibromo-4-ethynyl-phenyl)methanone Formula: C21H20Br2O MolecularWeight: 448.1909

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)C2=C(C=C(C=C2Br)C#C)Br)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)C2=C(C=C(C=C2Br)C#C)Br)C)C(C)(C)C

InChI

InChI=1S/C21H20Br2O/c1-7-14-10-16(22)19(17(23)11-14)20(24)18-12(2)8-15(9-13(18)3)21(4,5)6/h1,8-11H,2-6H3