2-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid

Systemtic Name: 2-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid Openeye Name: 2-[2-(4-ethoxyanilino)-1-methyl-2-oxo-ethoxy]-5-iodo-benzoic acid CAS Name: 2-[1-(4-ethoxyanilino)-1-oxopropan-2-yl]oxy-5-iodobenzoic acid IUPAC Name: 2-[1-(4-ethoxyanilino)-1-oxopropan-2-yl]oxy-5-iodobenzoic acid Traditional Name: 5-iodo-2-[2-keto-1-methyl-2-(p-phenetidino)ethoxy]benzoic acid Formula: C18H18INO5 MolecularWeight: 455.24369

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C18H18INO5/c1-3-24-14-7-5-13(6-8-14)20-17(21)11(2)25-16-9-4-12(19)10-15(16)18(22)23/h4-11H,3H2,1-2H3,(H,20,21)(H,22,23)