(1S,4S,8R)-2,2-dimethoxy-8-phenylmethoxy-bicyclo[2.2.2]oct-5-en-3-one

Systemtic Name: (1S,4S,8R)-2,2-dimethoxy-8-phenylmethoxy-bicyclo[2.2.2]oct-5-en-3-one Openeye Name: (1S,4S,8R)-8-benzyloxy-2,2-dimethoxy-bicyclo[2.2.2]oct-5-en-3-one CAS Name: (1S,4S,8R)-2,2-dimethoxy-8-phenylmethoxy-3-bicyclo[2.2.2]oct-5-enone IUPAC Name: (1S,4S,8R)-2,2-dimethoxy-8-phenylmethoxybicyclo[2.2.2]oct-5-en-3-one Traditional Name: (1S,4S,8R)-8-benzoxy-2,2-dimethoxy-bicyclo[2.2.2]oct-5-en-3-one Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C2CC(C(C1=O)C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1([C@H]2C[C@H]([C@@H](C1=O)C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C17H20O4/c1-19-17(20-2)13-8-9-14(16(17)18)15(10-13)21-11-12-6-4-3-5-7-12/h3-9,13-15H,10-11H2,1-2H3/t13-,14+,15-/m1/s1