[(1R,4S,5R,6R)-4,5,6-triacetyloxycyclohex-2-en-1-yl]methyl benzoate

Systemtic Name: [(1R,4S,5R,6R)-4,5,6-triacetyloxycyclohex-2-en-1-yl]methyl benzoate Openeye Name: [(1R,4S,5R,6R)-4,5,6-triacetoxycyclohex-2-en-1-yl]methyl benzoate CAS Name: benzoic acid [(1R,4S,5R,6R)-4,5,6-triacetyloxy-1-cyclohex-2-enyl]methyl ester IUPAC Name: [(1R,4S,5R,6R)-4,5,6-triacetyloxycyclohex-2-en-1-yl]methyl benzoate Traditional Name: benzoic acid [(1R,4S,5R,6R)-4,5,6-triacetoxycyclohex-2-en-1-yl]methyl ester Formula: C20H22O8 MolecularWeight: 390.38388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CC(C(C1OC(=O)C)OC(=O)C)COC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H22O8/c1-12(21)26-17-10-9-16(11-25-20(24)15-7-5-4-6-8-15)18(27-13(2)22)19(17)28-14(3)23/h4-10,16-19H,11H2,1-3H3/t16-,17+,18-,19-/m1/s1