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

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 3-(3-methylphenoxy)propanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 3-(3-methylphenoxy)propanoate CAS Name: 3-(3-methylphenoxy)propanoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 3-(3-methylphenoxy)propanoate Traditional Name: 3-(3-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=C1)OCCC(=O)OCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)OCC(=O)NC2=CC(=CC=C2)I

InChI

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