methyl (E,3R,4S,5R)-4-chloranyl-3,5-bis(oxidanyl)non-6-enoate

Systemtic Name: methyl (E,3R,4S,5R)-4-chloranyl-3,5-bis(oxidanyl)non-6-enoate Openeye Name: methyl (E,3R,4S,5R)-4-chloro-3,5-dihydroxy-non-6-enoate CAS Name: (E,3R,4S,5R)-4-chloro-3,5-dihydroxy-6-nonenoic acid methyl ester IUPAC Name: methyl (E,3R,4S,5R)-4-chloro-3,5-dihydroxynon-6-enoate Traditional Name: (E,3R,4S,5R)-4-chloro-3,5-dihydroxy-non-6-enoic acid methyl ester Formula: C10H17ClO4 MolecularWeight: 236.69258

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(C(C(CC(=O)OC)O)Cl)O

Isomeric SMILES

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

InChI

InChI=1S/C10H17ClO4/c1-3-4-5-7(12)10(11)8(13)6-9(14)15-2/h4-5,7-8,10,12-13H,3,6H2,1-2H3/b5-4+/t7-,8-,10-/m1/s1