[1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxyethanoate

Systemtic Name: [1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxyethanoate Openeye Name: [2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl] 2-[(5-chloro-7-iodo-8-quinolyl)oxy]acetate CAS Name: 2-[(5-chloro-7-iodo-8-quinolinyl)oxy]acetic acid [1-(2-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methoxyanilino)-1-oxopropan-2-yl] 2-(5-chloro-7-iodoquinolin-8-yl)oxyacetate Traditional Name: 2-[(5-chloro-7-iodo-8-quinolyl)oxy]acetic acid [2-keto-1-methyl-2-(o-anisidino)ethyl] ester Formula: C21H18ClIN2O5 MolecularWeight: 540.73549

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)OC(=O)COC2=C(C=C(C3=C2N=CC=C3)Cl)I

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1OC)OC(=O)COC2=C(C=C(C3=C2N=CC=C3)Cl)I

InChI

InChI=1S/C21H18ClIN2O5/c1-12(21(27)25-16-7-3-4-8-17(16)28-2)30-18(26)11-29-20-15(23)10-14(22)13-6-5-9-24-19(13)20/h3-10,12H,11H2,1-2H3,(H,25,27)