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

Systemtic Name: 2-[4-(4-isoquinolin-1-ylpiperazin-1-yl)butyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[4-[4-(1-isoquinolyl)piperazin-1-yl]butyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[4-[4-(1-isoquinolinyl)-1-piperazinyl]butyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[4-(4-isoquinolin-1-ylpiperazin-1-yl)butyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[4-[4-(1-isoquinolyl)piperazino]butyl]-3,4-dihydroisocarbostyril Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=CC=CC=C21)CCCCN3CCN(CC3)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(C(=O)C2=CC=CC=C21)CCCCN3CCN(CC3)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C26H30N4O/c31-26-24-10-4-2-8-22(24)12-16-30(26)15-6-5-14-28-17-19-29(20-18-28)25-23-9-3-1-7-21(23)11-13-27-25/h1-4,7-11,13H,5-6,12,14-20H2