5-iodanyl-2-[1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl]oxy-benzoic acid

Systemtic Name: 5-iodanyl-2-[1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl]oxy-benzoic acid Openeye Name: 5-iodo-2-[2-(2-isopropylanilino)-1-methyl-2-oxo-ethoxy]benzoic acid CAS Name: 5-iodo-2-[1-oxo-1-(2-propan-2-ylanilino)propan-2-yl]oxybenzoic acid IUPAC Name: 5-iodo-2-[1-oxo-1-(2-propan-2-ylanilino)propan-2-yl]oxybenzoic acid Traditional Name: 5-iodo-2-[2-(2-isopropylanilino)-2-keto-1-methyl-ethoxy]benzoic acid Formula: C19H20INO4 MolecularWeight: 453.27087

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C(C)OC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C(C)OC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C19H20INO4/c1-11(2)14-6-4-5-7-16(14)21-18(22)12(3)25-17-9-8-13(20)10-15(17)19(23)24/h4-12H,1-3H3,(H,21,22)(H,23,24)