O1-ethyl O8-methyl (E,4S,5S,6R)-5-methoxy-4,6-bis(oxidanyl)oct-2-enedioate

Systemtic Name: O1-ethyl O8-methyl (E,4S,5S,6R)-5-methoxy-4,6-bis(oxidanyl)oct-2-enedioate Openeye Name: O1-ethyl O8-methyl (E,4S,5S,6R)-4,6-dihydroxy-5-methoxy-oct-2-enedioate CAS Name: (E,4S,5S,6R)-4,6-dihydroxy-5-methoxy-2-octenedioic acid O1-ethyl ester O8-methyl ester IUPAC Name: 1-O-ethyl 8-O-methyl (E,4S,5S,6R)-4,6-dihydroxy-5-methoxyoct-2-enedioate Traditional Name: (E,4S,5S,6R)-4,6-dihydroxy-5-methoxy-oct-2-enedioic acid O1-ethyl ester O8-methyl ester Formula: C12H20O7 MolecularWeight: 276.283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20O7/c1-4-19-10(15)6-5-8(13)12(18-3)9(14)7-11(16)17-2/h5-6,8-9,12-14H,4,7H2,1-3H3/b6-5+/t8-,9+,12+/m0/s1