9-bromanyl-6-[2-(4-ethanoylpiperazin-1-yl)ethyl]-2H-benzo[h]isoquinolin-1-one

Systemtic Name: 9-bromanyl-6-[2-(4-ethanoylpiperazin-1-yl)ethyl]-2H-benzo[h]isoquinolin-1-one Openeye Name: 6-[2-(4-acetylpiperazin-1-yl)ethyl]-9-bromo-2H-benzo[h]isoquinolin-1-one CAS Name: 6-[2-(4-acetyl-1-piperazinyl)ethyl]-9-bromo-2H-benzo[h]isoquinolin-1-one IUPAC Name: 6-[2-(4-acetylpiperazin-1-yl)ethyl]-9-bromo-2H-benzo[h]isoquinolin-1-one Traditional Name: 6-[2-(4-acetylpiperazino)ethyl]-9-bromo-2H-benz[h]isoquinolin-1-one Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CCC2=C3C=CC(=CC3=C4C(=C2)C=CNC4=O)Br

Isomeric SMILES

CC(=O)N1CCN(CC1)CCC2=C3C=CC(=CC3=C4C(=C2)C=CNC4=O)Br

InChI

InChI=1S/C21H22BrN3O2/c1-14(26)25-10-8-24(9-11-25)7-5-15-12-16-4-6-23-21(27)20(16)19-13-17(22)2-3-18(15)19/h2-4,6,12-13H,5,7-11H2,1H3,(H,23,27)