methyl (2S,3R)-5-iodanyl-2-methyl-3-[(E)-3-oxidanylidenehex-1-enoxy]pentanoate

Systemtic Name: methyl (2S,3R)-5-iodanyl-2-methyl-3-[(E)-3-oxidanylidenehex-1-enoxy]pentanoate Openeye Name: methyl (2S,3R)-5-iodo-2-methyl-3-[(E)-3-oxohex-1-enoxy]pentanoate CAS Name: (2S,3R)-5-iodo-2-methyl-3-[(E)-3-oxohex-1-enoxy]pentanoic acid methyl ester IUPAC Name: methyl (2S,3R)-5-iodo-2-methyl-3-[(E)-3-oxohex-1-enoxy]pentanoate Traditional Name: (2S,3R)-5-iodo-3-[(E)-3-ketohex-1-enoxy]-2-methyl-valeric acid methyl ester Formula: C13H21IO4 MolecularWeight: 368.20791

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C=COC(CCI)C(C)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C13H21IO4/c1-4-5-11(15)7-9-18-12(6-8-14)10(2)13(16)17-3/h7,9-10,12H,4-6,8H2,1-3H3/b9-7+/t10-,12+/m0/s1