ethyl 4-(4-bromanyl-6,7-dimethoxy-1-oxidanylidene-isoquinolin-2-yl)butanoate

Systemtic Name: ethyl 4-(4-bromanyl-6,7-dimethoxy-1-oxidanylidene-isoquinolin-2-yl)butanoate Openeye Name: ethyl 4-(4-bromo-6,7-dimethoxy-1-oxo-2-isoquinolyl)butanoate CAS Name: 4-(4-bromo-6,7-dimethoxy-1-oxo-2-isoquinolinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-6,7-dimethoxy-1-oxoisoquinolin-2-yl)butanoate Traditional Name: 4-(4-bromo-1-keto-6,7-dimethoxy-2-isoquinolyl)butyric acid ethyl ester Formula: C17H20BrNO5 MolecularWeight: 398.2484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)Br

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)Br

InChI

InChI=1S/C17H20BrNO5/c1-4-24-16(20)6-5-7-19-10-13(18)11-8-14(22-2)15(23-3)9-12(11)17(19)21/h8-10H,4-7H2,1-3H3