ethyl 2-acetamido-3-(3-iodanyl-5-methyl-4-oxidanyl-phenyl)propanoate

Systemtic Name: ethyl 2-acetamido-3-(3-iodanyl-5-methyl-4-oxidanyl-phenyl)propanoate Openeye Name: ethyl 2-acetamido-3-(4-hydroxy-3-iodo-5-methyl-phenyl)propanoate CAS Name: 2-acetamido-3-(4-hydroxy-3-iodo-5-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-(4-hydroxy-3-iodo-5-methylphenyl)propanoate Traditional Name: 2-acetamido-3-(4-hydroxy-3-iodo-5-methyl-phenyl)propionic acid ethyl ester Formula: C14H18INO4 MolecularWeight: 391.20149

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18INO4/c1-4-20-14(19)12(16-9(3)17)7-10-5-8(2)13(18)11(15)6-10/h5-6,12,18H,4,7H2,1-3H3,(H,16,17)