2-(2-ethanoyl-1H-isoquinolin-1-yl)-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2-ethanoyl-1H-isoquinolin-1-yl)-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-1-(4-phenylpiperazino)ethanone Formula: C23H25N3O2 MolecularWeight: 375.4635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2/c1-18(27)26-12-11-19-7-5-6-10-21(19)22(26)17-23(28)25-15-13-24(14-16-25)20-8-3-2-4-9-20/h2-12,22H,13-17H2,1H3