[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl] 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl] 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid [2-(3-iodoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl] 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid [2-(3-iodoanilino)-2-keto-ethyl] ester Formula: C22H18INO4 MolecularWeight: 487.28709

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCC(=O)NC3=CC(=CC=C3)I)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(=O)OCC(=O)NC3=CC(=CC=C3)I)O

InChI

InChI=1S/C22H18INO4/c23-18-12-7-13-19(14-18)24-20(25)15-28-21(26)22(27,16-8-3-1-4-9-16)17-10-5-2-6-11-17/h1-14,27H,15H2,(H,24,25)