2-[1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid

Systemtic Name: 2-[1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]oxy-5-iodanyl-benzoic acid Openeye Name: 2-[2-(4-chloro-2-methoxy-5-methyl-anilino)-1-methyl-2-oxo-ethoxy]-5-iodo-benzoic acid CAS Name: 2-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]oxy-5-iodobenzoic acid IUPAC Name: 2-[1-(4-chloro-2-methoxy-5-methylanilino)-1-oxopropan-2-yl]oxy-5-iodobenzoic acid Traditional Name: 2-[2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-1-methyl-ethoxy]-5-iodo-benzoic acid Formula: C18H17ClINO5 MolecularWeight: 489.68875

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClINO5/c1-9-6-14(16(25-3)8-13(9)19)21-17(22)10(2)26-15-5-4-11(20)7-12(15)18(23)24/h4-8,10H,1-3H3,(H,21,22)(H,23,24)