[(3aR,5R,6S,6aR)-5-[(1R)-1,2-diacetyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] benzoate

Systemtic Name: [(3aR,5R,6S,6aR)-5-[(1R)-1,2-diacetyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] benzoate Openeye Name: [(3aR,5R,6S,6aR)-5-[(1R)-1,2-diacetoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] benzoate CAS Name: benzoic acid [(3aR,5R,6S,6aR)-5-[(1R)-1,2-diacetyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] ester IUPAC Name: [(3aR,5R,6S,6aR)-5-[(1R)-1,2-diacetyloxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] benzoate Traditional Name: benzoic acid [(3aR,5R,6S,6aR)-5-[(1R)-1,2-diacetoxyethyl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] ester Formula: C20H24O9 MolecularWeight: 408.39916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C1C(C2C(O1)OC(O2)(C)C)OC(=O)C3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)OC(=O)C3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C20H24O9/c1-11(21)24-10-14(25-12(2)22)15-16(17-19(27-15)29-20(3,4)28-17)26-18(23)13-8-6-5-7-9-13/h5-9,14-17,19H,10H2,1-4H3/t14-,15-,16+,17-,19-/m1/s1