[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-phenyl-butanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 4-oxo-4-phenyl-butanoate CAS Name: 4-oxo-4-phenylbutanoic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 4-oxo-4-phenylbutanoate Traditional Name: 4-keto-4-phenyl-butyric acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C18H16INO4 MolecularWeight: 437.22841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CCC(=O)OCC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C18H16INO4/c19-14-7-4-8-15(11-14)20-17(22)12-24-18(23)10-9-16(21)13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,20,22)