(2-cyanophenyl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (2-cyanophenyl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (2-cyanobenzyl) ester Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C18H19NO3/c19-10-14-4-1-2-5-15(14)11-22-18(21)16-8-12-6-3-7-13(9-16)17(12)20/h1-2,4-5,12-13,16H,3,6-9,11H2