methyl 4-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxybutanoate

Systemtic Name: methyl 4-(5-chloranyl-7-iodanyl-quinolin-8-yl)oxybutanoate Openeye Name: methyl 4-[(5-chloro-7-iodo-8-quinolyl)oxy]butanoate CAS Name: 4-[(5-chloro-7-iodo-8-quinolinyl)oxy]butanoic acid methyl ester IUPAC Name: methyl 4-(5-chloro-7-iodoquinolin-8-yl)oxybutanoate Traditional Name: 4-[(5-chloro-7-iodo-8-quinolyl)oxy]butyric acid methyl ester Formula: C14H13ClINO3 MolecularWeight: 405.61539

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=C(C=C(C2=C1N=CC=C2)Cl)I

Isomeric SMILES

COC(=O)CCCOC1=C(C=C(C2=C1N=CC=C2)Cl)I

InChI

InChI=1S/C14H13ClINO3/c1-19-12(18)5-3-7-20-14-11(16)8-10(15)9-4-2-6-17-13(9)14/h2,4,6,8H,3,5,7H2,1H3