[(1R,2R,6S)-2-acetyloxy-6-(phenylcarbonyloxy)cyclohex-3-en-1-yl]methyl benzoate

Systemtic Name: [(1R,2R,6S)-2-acetyloxy-6-(phenylcarbonyloxy)cyclohex-3-en-1-yl]methyl benzoate Openeye Name: [(1R,2R,6S)-2-acetoxy-6-benzoyloxy-cyclohex-3-en-1-yl]methyl benzoate CAS Name: benzoic acid [(1R,2R,6S)-2-acetyloxy-6-benzoyloxy-1-cyclohex-3-enyl]methyl ester IUPAC Name: [(1R,2R,6S)-2-acetyloxy-6-benzoyloxycyclohex-3-en-1-yl]methyl benzoate Traditional Name: benzoic acid [(1R,2R,6S)-2-acetoxy-6-benzoyloxy-cyclohex-3-en-1-yl]methyl ester Formula: C23H22O6 MolecularWeight: 394.41718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CCC(C1COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C23H22O6/c1-16(24)28-20-13-8-14-21(29-23(26)18-11-6-3-7-12-18)19(20)15-27-22(25)17-9-4-2-5-10-17/h2-13,19-21H,14-15H2,1H3/t19-,20+,21-/m0/s1