(phenylmethyl) (1R,4R,5R)-bicyclo[2.2.2]oct-2-ene-5-carboxylate

Systemtic Name: (phenylmethyl) (1R,4R,5R)-bicyclo[2.2.2]oct-2-ene-5-carboxylate Openeye Name: benzyl (1R,4R,5R)-bicyclo[2.2.2]oct-2-ene-5-carboxylate CAS Name: (1R,4R,5R)-5-bicyclo[2.2.2]oct-2-enecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1R,4R,5R)-bicyclo[2.2.2]oct-2-ene-5-carboxylate Traditional Name: (1R,4R,5R)-bicyclo[2.2.2]oct-2-ene-5-carboxylic acid benzyl ester Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC1CC2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H]2C=C[C@H]1C[C@H]2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C16H18O2/c17-16(18-11-13-4-2-1-3-5-13)15-10-12-6-8-14(15)9-7-12/h1-6,8,12,14-15H,7,9-11H2/t12-,14+,15-/m1/s1