[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2,4-dimethoxyphenyl)ethanoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2-(2,4-dimethoxyphenyl)ethanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 2-(2,4-dimethoxyphenyl)acetate CAS Name: 2-(2,4-dimethoxyphenyl)acetic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 2-(2,4-dimethoxyphenyl)acetate Traditional Name: 2-(2,4-dimethoxyphenyl)acetic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C18H18INO5 MolecularWeight: 455.24369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC(=O)OCC(=O)NC2=CC(=CC=C2)I)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CC(=O)OCC(=O)NC2=CC(=CC=C2)I)OC

InChI

InChI=1S/C18H18INO5/c1-23-15-7-6-12(16(10-15)24-2)8-18(22)25-11-17(21)20-14-5-3-4-13(19)9-14/h3-7,9-10H,8,11H2,1-2H3,(H,20,21)