(1S,5R)-4-(2-phenylethynyl)bicyclo[3.2.1]oct-3-en-8-one

Systemtic Name: (1S,5R)-4-(2-phenylethynyl)bicyclo[3.2.1]oct-3-en-8-one Openeye Name: (1S,5R)-4-(2-phenylethynyl)bicyclo[3.2.1]oct-3-en-8-one CAS Name: (1S,5R)-4-(2-phenylethynyl)-8-bicyclo[3.2.1]oct-3-enone IUPAC Name: (1S,5R)-4-(2-phenylethynyl)bicyclo[3.2.1]oct-3-en-8-one Traditional Name: (1S,5R)-4-(2-phenylethynyl)bicyclo[3.2.1]oct-3-en-8-one Formula: C16H14O MolecularWeight: 222.28176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(=CCC1C2=O)C#CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]2C(=CC[C@H]1C2=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C16H14O/c17-16-14-9-8-13(15(16)11-10-14)7-6-12-4-2-1-3-5-12/h1-5,8,14-15H,9-11H2/t14-,15-/m1/s1