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

Systemtic Name: [1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxyethanoate Openeye Name: [2-(cyclopropylamino)-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-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylamino)-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-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H16ClIN2O4 MolecularWeight: 474.67741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)COC2=C(C=C(C3=C2N=CC=C3)Cl)I

Isomeric SMILES

CC(C(=O)NC1CC1)OC(=O)COC2=C(C=C(C3=C2N=CC=C3)Cl)I

InChI

InChI=1S/C17H16ClIN2O4/c1-9(17(23)21-10-4-5-10)25-14(22)8-24-16-13(19)7-12(18)11-3-2-6-20-15(11)16/h2-3,6-7,9-10H,4-5,8H2,1H3,(H,21,23)