(4-ethanoylphenyl) (1R,5S)-9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (4-ethanoylphenyl) (1R,5S)-9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (4-acetylphenyl) (1R,5S)-9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: (1R,5S)-9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) (1R,5S)-9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: (1R,5S)-9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (4-acetylphenyl) ester Formula: C18H20O4 MolecularWeight: 300.349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2CC3CCCC(C2)C3=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O

InChI

InChI=1S/C18H20O4/c1-11(19)12-5-7-16(8-6-12)22-18(21)15-9-13-3-2-4-14(10-15)17(13)20/h5-8,13-15H,2-4,9-10H2,1H3/t13-,14+,15?