[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxyethanoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxyethanoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-[(5-chloro-7-iodo-8-quinolyl)oxy]acetate CAS Name: 2-[(5-chloro-7-iodo-8-quinolinyl)oxy]acetic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-(5-chloro-7-iodoquinolin-8-yl)oxyacetate Traditional Name: 2-[(5-chloro-7-iodo-8-quinolyl)oxy]acetic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C17H18ClIN2O4 MolecularWeight: 476.69329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)COC1=C(C=C(C2=C1N=CC=C2)Cl)I

Isomeric SMILES

CCC(C)NC(=O)COC(=O)COC1=C(C=C(C2=C1N=CC=C2)Cl)I

InChI

InChI=1S/C17H18ClIN2O4/c1-3-10(2)21-14(22)8-24-15(23)9-25-17-13(19)7-12(18)11-5-4-6-20-16(11)17/h4-7,10H,3,8-9H2,1-2H3,(H,21,22)