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

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxyethanoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2-[(5-chloro-7-iodo-8-quinolyl)oxy]acetate CAS Name: 2-[(5-chloro-7-iodo-8-quinolinyl)oxy]acetic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 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-phenyl-ethyl] ester Formula: C22H18ClIN2O4 MolecularWeight: 536.74679

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)COC3=C(C=C(C4=C3N=CC=C4)Cl)I

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)COC3=C(C=C(C4=C3N=CC=C4)Cl)I

InChI

InChI=1S/C22H18ClIN2O4/c23-16-11-17(24)21(19-15(16)7-4-10-25-19)29-12-18(27)30-20(13-5-2-1-3-6-13)22(28)26-14-8-9-14/h1-7,10-11,14,20H,8-9,12H2,(H,26,28)