(1R,5S)-3-bromanyl-2-(2-phenylethynyl)-8-oxabicyclo[3.2.1]octa-2,6-dien-4-one

Systemtic Name: (1R,5S)-3-bromanyl-2-(2-phenylethynyl)-8-oxabicyclo[3.2.1]octa-2,6-dien-4-one Openeye Name: (1R,5S)-3-bromo-2-(2-phenylethynyl)-8-oxabicyclo[3.2.1]octa-2,6-dien-4-one CAS Name: (1R,5S)-3-bromo-2-(2-phenylethynyl)-8-oxabicyclo[3.2.1]octa-2,6-dien-4-one IUPAC Name: (1R,5S)-3-bromo-2-(2-phenylethynyl)-8-oxabicyclo[3.2.1]octa-2,6-dien-4-one Traditional Name: (1R,5S)-3-bromo-2-(2-phenylethynyl)-8-oxabicyclo[3.2.1]octa-2,6-dien-4-one Formula: C15H9BrO2 MolecularWeight: 301.13476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C(=O)C3C=CC2O3)Br

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C(=O)[C@@H]3C=C[C@H]2O3)Br

InChI

InChI=1S/C15H9BrO2/c16-14-11(7-6-10-4-2-1-3-5-10)12-8-9-13(18-12)15(14)17/h1-5,8-9,12-13H/t12-,13+/m1/s1