ethyl 4-(2-methyl-1-oxidanylidene-isoquinolin-5-yl)oxy-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(2-methyl-1-oxidanylidene-isoquinolin-5-yl)oxy-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[(2-methyl-1-oxo-5-isoquinolyl)oxy]-3-oxo-butanoate CAS Name: 4-[(2-methyl-1-oxo-5-isoquinolinyl)oxy]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(2-methyl-1-oxoisoquinolin-5-yl)oxy-3-oxobutanoate Traditional Name: 3-keto-4-[(1-keto-2-methyl-5-isoquinolyl)oxy]butyric acid ethyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO5/c1-3-21-15(19)9-11(18)10-22-14-6-4-5-13-12(14)7-8-17(2)16(13)20/h4-8H,3,9-10H2,1-2H3