ethyl 4-[4,5-bis(fluoranyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-2-yl]butanoate

Systemtic Name: ethyl 4-[4,5-bis(fluoranyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-2-yl]butanoate Openeye Name: ethyl 4-(4,5-difluoro-6,7-dimethoxy-1-oxo-2-isoquinolyl)butanoate CAS Name: 4-(4,5-difluoro-6,7-dimethoxy-1-oxo-2-isoquinolinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(4,5-difluoro-6,7-dimethoxy-1-oxoisoquinolin-2-yl)butanoate Traditional Name: 4-(4,5-difluoro-1-keto-6,7-dimethoxy-2-isoquinolyl)butyric acid ethyl ester Formula: C17H19F2NO5 MolecularWeight: 355.333266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=C(C(=C(C=C2C1=O)OC)OC)F)F

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=C(C(=C(C=C2C1=O)OC)OC)F)F

InChI

InChI=1S/C17H19F2NO5/c1-4-25-13(21)6-5-7-20-9-11(18)14-10(17(20)22)8-12(23-2)16(24-3)15(14)19/h8-9H,4-7H2,1-3H3