methyl (3R,4S,5R)-3,4,5-triacetyloxycyclohexene-1-carboxylate

Systemtic Name: methyl (3R,4S,5R)-3,4,5-triacetyloxycyclohexene-1-carboxylate Openeye Name: methyl (3R,4S,5R)-3,4,5-triacetoxycyclohexene-1-carboxylate CAS Name: (3R,4S,5R)-3,4,5-triacetyloxy-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (3R,4S,5R)-3,4,5-triacetyloxycyclohexene-1-carboxylate Traditional Name: (3R,4S,5R)-3,4,5-triacetoxycyclohexene-1-carboxylic acid methyl ester Formula: C14H18O8 MolecularWeight: 314.28792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=CC(C1OC(=O)C)OC(=O)C)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H18O8/c1-7(15)20-11-5-10(14(18)19-4)6-12(21-8(2)16)13(11)22-9(3)17/h5,11-13H,6H2,1-4H3/t11-,12-,13-/m1/s1