(3,3-dimethyl-2-oxidanylidene-butyl) 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)acetic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H19NO5/c1-17(2,3)13(19)10-23-15(21)9-18-14(20)8-11-6-4-5-7-12(11)16(18)22/h4-7H,8-10H2,1-3H3