methyl (E,4R,5S,6R)-4-acetyloxy-6-methoxy-5-methyl-7-oxidanylidene-oct-2-enoate

Systemtic Name: methyl (E,4R,5S,6R)-4-acetyloxy-6-methoxy-5-methyl-7-oxidanylidene-oct-2-enoate Openeye Name: methyl (E,4R,5S,6R)-4-acetoxy-6-methoxy-5-methyl-7-oxo-oct-2-enoate CAS Name: (E,4R,5S,6R)-4-acetyloxy-6-methoxy-5-methyl-7-oxo-2-octenoic acid methyl ester IUPAC Name: methyl (E,4R,5S,6R)-4-acetyloxy-6-methoxy-5-methyl-7-oxooct-2-enoate Traditional Name: (E,4R,5S,6R)-4-acetoxy-7-keto-6-methoxy-5-methyl-oct-2-enoic acid methyl ester Formula: C13H20O6 MolecularWeight: 272.2943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C=CC(=O)OC)OC(=O)C)C(C(=O)C)OC

Isomeric SMILES

C[C@@H]([C@@H](/C=C/C(=O)OC)OC(=O)C)[C@H](C(=O)C)OC

InChI

InChI=1S/C13H20O6/c1-8(13(18-5)9(2)14)11(19-10(3)15)6-7-12(16)17-4/h6-8,11,13H,1-5H3/b7-6+/t8-,11+,13+/m0/s1