methyl (1R,4R,5R)-3-oxidanylidene-5-phenyl-2-oxabicyclo[2.2.2]octane-4-carboxylate

Systemtic Name: methyl (1R,4R,5R)-3-oxidanylidene-5-phenyl-2-oxabicyclo[2.2.2]octane-4-carboxylate Openeye Name: methyl (1R,4R,5R)-3-oxo-5-phenyl-2-oxabicyclo[2.2.2]octane-4-carboxylate CAS Name: (1R,4R,5R)-3-oxo-5-phenyl-2-oxabicyclo[2.2.2]octane-4-carboxylic acid methyl ester IUPAC Name: methyl (1R,4R,5R)-3-oxo-5-phenyl-2-oxabicyclo[2.2.2]octane-4-carboxylate Traditional Name: (1R,4R,5R)-3-keto-5-phenyl-2-oxabicyclo[2.2.2]octane-4-carboxylic acid methyl ester Formula: C15H16O4 MolecularWeight: 260.28514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CCC(CC1C3=CC=CC=C3)OC2=O

Isomeric SMILES

COC(=O)[C@@]12CC[C@H](C[C@@H]1C3=CC=CC=C3)OC2=O

InChI

InChI=1S/C15H16O4/c1-18-13(16)15-8-7-11(19-14(15)17)9-12(15)10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3/t11-,12-,15-/m1/s1