methyl (E)-4-[(4R,6R)-2-oxidanylidene-6-[(2R)-1-oxidanylpropan-2-yl]oxan-4-yl]but-2-enoate

Systemtic Name: methyl (E)-4-[(4R,6R)-2-oxidanylidene-6-[(2R)-1-oxidanylpropan-2-yl]oxan-4-yl]but-2-enoate Openeye Name: methyl (E)-4-[(2R,4R)-2-[(1R)-2-hydroxy-1-methyl-ethyl]-6-oxo-tetrahydropyran-4-yl]but-2-enoate CAS Name: (E)-4-[(2R,4R)-2-[(2R)-1-hydroxypropan-2-yl]-6-oxo-4-oxanyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-[(2R,4R)-2-[(2R)-1-hydroxypropan-2-yl]-6-oxooxan-4-yl]but-2-enoate Traditional Name: (E)-4-[(2R,4R)-2-[(1R)-2-hydroxy-1-methyl-ethyl]-6-keto-tetrahydropyran-4-yl]but-2-enoic acid methyl ester Formula: C13H20O5 MolecularWeight: 256.2949

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C1CC(CC(=O)O1)CC=CC(=O)OC

Isomeric SMILES

C[C@H](CO)[C@H]1C[C@H](CC(=O)O1)C/C=C/C(=O)OC

InChI

InChI=1S/C13H20O5/c1-9(8-14)11-6-10(7-13(16)18-11)4-3-5-12(15)17-2/h3,5,9-11,14H,4,6-8H2,1-2H3/b5-3+/t9-,10-,11-/m1/s1