phenyl (Z,3S)-5-iodanyl-4-methyl-3-oxidanyl-pent-4-enoate

Systemtic Name: phenyl (Z,3S)-5-iodanyl-4-methyl-3-oxidanyl-pent-4-enoate Openeye Name: phenyl (Z,3S)-3-hydroxy-5-iodo-4-methyl-pent-4-enoate CAS Name: (Z,3S)-3-hydroxy-5-iodo-4-methyl-4-pentenoic acid phenyl ester IUPAC Name: phenyl (Z,3S)-3-hydroxy-5-iodo-4-methylpent-4-enoate Traditional Name: (Z,3S)-3-hydroxy-5-iodo-4-methyl-pent-4-enoic acid phenyl ester Formula: C12H13IO3 MolecularWeight: 332.13429

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CI)C(CC(=O)OC1=CC=CC=C1)O

Isomeric SMILES

C/C(=C/I)/[C@H](CC(=O)OC1=CC=CC=C1)O

InChI

InChI=1S/C12H13IO3/c1-9(8-13)11(14)7-12(15)16-10-5-3-2-4-6-10/h2-6,8,11,14H,7H2,1H3/b9-8-/t11-/m0/s1