[(1S,2S)-4-methanoyl-2-(phenylcarbonyloxy)cyclohexyl] benzoate

Systemtic Name: [(1S,2S)-4-methanoyl-2-(phenylcarbonyloxy)cyclohexyl] benzoate Openeye Name: [(1S,2S)-2-benzoyloxy-4-formyl-cyclohexyl] benzoate CAS Name: benzoic acid [(1S,2S)-2-benzoyloxy-4-formylcyclohexyl] ester IUPAC Name: [(1S,2S)-2-benzoyloxy-4-formylcyclohexyl] benzoate Traditional Name: benzoic acid [(1S,2S)-2-benzoyloxy-4-formyl-cyclohexyl] ester Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1C=O)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(C[C@@H]([C@H]1OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C=O

InChI

InChI=1S/C21H20O5/c22-14-15-11-12-18(25-20(23)16-7-3-1-4-8-16)19(13-15)26-21(24)17-9-5-2-6-10-17/h1-10,14-15,18-19H,11-13H2/t15?,18-,19-/m0/s1