tert-butyl 2-ethanoyl-3-oxidanylidene-5-(1-oxidanylideneisoquinolin-2-yl)pentanoate

Systemtic Name: tert-butyl 2-ethanoyl-3-oxidanylidene-5-(1-oxidanylideneisoquinolin-2-yl)pentanoate Openeye Name: tert-butyl 2-acetyl-3-oxo-5-(1-oxo-2-isoquinolyl)pentanoate CAS Name: 2-acetyl-3-oxo-5-(1-oxo-2-isoquinolinyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetyl-3-oxo-5-(1-oxoisoquinolin-2-yl)pentanoate Traditional Name: 2-acetyl-3-keto-5-(1-keto-2-isoquinolyl)valeric acid tert-butyl ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)CCN1C=CC2=CC=CC=C2C1=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(C(=O)CCN1C=CC2=CC=CC=C2C1=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H23NO5/c1-13(22)17(19(25)26-20(2,3)4)16(23)10-12-21-11-9-14-7-5-6-8-15(14)18(21)24/h5-9,11,17H,10,12H2,1-4H3