[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-methylphenoxy)propanoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-methylphenoxy)propanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 3-(2-methylphenoxy)propanoate CAS Name: 3-(2-methylphenoxy)propanoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 3-(2-methylphenoxy)propanoate Traditional Name: 3-(2-methylphenoxy)propionic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C18H18INO4 MolecularWeight: 439.24429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)OCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)OCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C18H18INO4/c1-13-5-2-3-8-16(13)23-10-9-18(22)24-12-17(21)20-15-7-4-6-14(19)11-15/h2-8,11H,9-10,12H2,1H3,(H,20,21)