2-[2-(4-isoquinolin-1-ylpiperazin-1-yl)ethyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[2-(4-isoquinolin-1-ylpiperazin-1-yl)ethyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[2-[4-(1-isoquinolyl)piperazin-1-yl]ethyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[2-[4-(1-isoquinolinyl)-1-piperazinyl]ethyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[2-(4-isoquinolin-1-ylpiperazin-1-yl)ethyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[2-[4-(1-isoquinolyl)piperazino]ethyl]-3,4-dihydroisocarbostyril Formula: C24H26N4O MolecularWeight: 386.48944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=CC=CC=C21)CCN3CCN(CC3)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(C(=O)C2=CC=CC=C21)CCN3CCN(CC3)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C24H26N4O/c29-24-22-8-4-2-6-20(22)10-12-28(24)18-15-26-13-16-27(17-14-26)23-21-7-3-1-5-19(21)9-11-25-23/h1-9,11H,10,12-18H2