ethyl (2S)-2-ethoxy-3-(3-iodanyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: ethyl (2S)-2-ethoxy-3-(3-iodanyl-4-oxidanyl-phenyl)propanoate Openeye Name: ethyl (2S)-2-ethoxy-3-(4-hydroxy-3-iodo-phenyl)propanoate CAS Name: (2S)-2-ethoxy-3-(4-hydroxy-3-iodophenyl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-ethoxy-3-(4-hydroxy-3-iodophenyl)propanoate Traditional Name: (2S)-2-ethoxy-3-(4-hydroxy-3-iodo-phenyl)propionic acid ethyl ester Formula: C13H17IO4 MolecularWeight: 364.17615

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC(=C(C=C1)O)I)C(=O)OCC

Isomeric SMILES

CCO[C@@H](CC1=CC(=C(C=C1)O)I)C(=O)OCC

InChI

InChI=1S/C13H17IO4/c1-3-17-12(13(16)18-4-2)8-9-5-6-11(15)10(14)7-9/h5-7,12,15H,3-4,8H2,1-2H3/t12-/m0/s1