2-[1-[(3-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid

Systemtic Name: 2-[1-[(3-chloranyl-2-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid Openeye Name: 2-[2-(3-chloro-2-methyl-anilino)-1-methyl-2-oxo-ethoxy]-5-iodo-benzoic acid CAS Name: 2-[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]oxy-5-iodobenzoic acid IUPAC Name: 2-[1-(3-chloro-2-methylanilino)-1-oxopropan-2-yl]oxy-5-iodobenzoic acid Traditional Name: 2-[2-(3-chloro-2-methyl-anilino)-2-keto-1-methyl-ethoxy]-5-iodo-benzoic acid Formula: C17H15ClINO4 MolecularWeight: 459.66277

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)OC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)OC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C17H15ClINO4/c1-9-13(18)4-3-5-14(9)20-16(21)10(2)24-15-7-6-11(19)8-12(15)17(22)23/h3-8,10H,1-2H3,(H,20,21)(H,22,23)