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

Systemtic Name: [2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate Openeye Name: [2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl] 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetic acid [2-(4-acetyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetylpiperazin-1-yl)-2-oxoethyl] 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)acetic acid [2-(4-acetylpiperazino)-2-keto-ethyl] ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)COC(=O)CN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)COC(=O)CN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H21N3O6/c1-13(23)20-6-8-21(9-7-20)17(25)12-28-18(26)11-22-16(24)10-14-4-2-3-5-15(14)19(22)27/h2-5H,6-12H2,1H3