ethyl 4-[4-bromanyl-6,7-bis(oxidanyl)-1-oxidanylidene-isoquinolin-2-yl]butanoate

Systemtic Name: ethyl 4-[4-bromanyl-6,7-bis(oxidanyl)-1-oxidanylidene-isoquinolin-2-yl]butanoate Openeye Name: ethyl 4-(4-bromo-6,7-dihydroxy-1-oxo-2-isoquinolyl)butanoate CAS Name: 4-(4-bromo-6,7-dihydroxy-1-oxo-2-isoquinolinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-bromo-6,7-dihydroxy-1-oxoisoquinolin-2-yl)butanoate Traditional Name: 4-(4-bromo-6,7-dihydroxy-1-keto-2-isoquinolyl)butyric acid ethyl ester Formula: C15H16BrNO5 MolecularWeight: 370.19524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16BrNO5/c1-2-22-14(20)4-3-5-17-8-11(16)9-6-12(18)13(19)7-10(9)15(17)21/h6-8,18-19H,2-5H2,1H3