methyl (2S,3S)-2-iodanyl-3-(4-methoxyphenyl)-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3S)-2-iodanyl-3-(4-methoxyphenyl)-3-oxidanyl-propanoate Openeye Name: methyl (2S,3S)-3-hydroxy-2-iodo-3-(4-methoxyphenyl)propanoate CAS Name: (2S,3S)-3-hydroxy-2-iodo-3-(4-methoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-hydroxy-2-iodo-3-(4-methoxyphenyl)propanoate Traditional Name: (2S,3S)-3-hydroxy-2-iodo-3-(4-methoxyphenyl)propionic acid methyl ester Formula: C11H13IO4 MolecularWeight: 336.12299

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C(=O)OC)I)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]([C@@H](C(=O)OC)I)O

InChI

InChI=1S/C11H13IO4/c1-15-8-5-3-7(4-6-8)10(13)9(12)11(14)16-2/h3-6,9-10,13H,1-2H3/t9-,10-/m0/s1