[(1R,4R,5S)-5-methanoyl-5-bicyclo[2.2.2]oct-2-enyl] cyclohexanecarboxylate

Systemtic Name: [(1R,4R,5S)-5-methanoyl-5-bicyclo[2.2.2]oct-2-enyl] cyclohexanecarboxylate Openeye Name: [(1R,4R,5S)-5-formyl-5-bicyclo[2.2.2]oct-2-enyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [(1R,4R,5S)-5-formyl-5-bicyclo[2.2.2]oct-2-enyl] ester IUPAC Name: [(1R,4R,5S)-5-formyl-5-bicyclo[2.2.2]oct-2-enyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [(1R,4R,5S)-5-formyl-5-bicyclo[2.2.2]oct-2-enyl] ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OC2(CC3CCC2C=C3)C=O

Isomeric SMILES

C1CCC(CC1)C(=O)O[C@]2(C[C@H]3CC[C@@H]2C=C3)C=O

InChI

InChI=1S/C16H22O3/c17-11-16(10-12-6-8-14(16)9-7-12)19-15(18)13-4-2-1-3-5-13/h6,8,11-14H,1-5,7,9-10H2/t12-,14+,16-/m1/s1