ethyl 4-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolyl]oxy]-3-oxo-butanoate CAS Name: 4-[[2-(2-methoxyethyl)-1-oxo-5-isoquinolinyl]oxy]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-methoxyethyl)-1-oxoisoquinolin-5-yl]oxy-3-oxobutanoate Traditional Name: 3-keto-4-[[1-keto-2-(2-methoxyethyl)-5-isoquinolyl]oxy]butyric acid ethyl ester Formula: C18H21NO6 MolecularWeight: 347.36244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)COC1=CC=CC2=C1C=CN(C2=O)CCOC

Isomeric SMILES

CCOC(=O)CC(=O)COC1=CC=CC2=C1C=CN(C2=O)CCOC

InChI

InChI=1S/C18H21NO6/c1-3-24-17(21)11-13(20)12-25-16-6-4-5-15-14(16)7-8-19(18(15)22)9-10-23-2/h4-8H,3,9-12H2,1-2H3