2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-[4-(2-pyridyl)piperazin-1-yl]butyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-[4-(2-pyridinyl)-1-piperazinyl]butyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-[4-(2-pyridyl)piperazino]butyl]benzo[de]isoquinoline-1,3-quinone Formula: C25H26N4O2 MolecularWeight: 414.49954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC=CC=N5

InChI

InChI=1S/C25H26N4O2/c30-24-20-9-5-7-19-8-6-10-21(23(19)20)25(31)29(24)14-4-3-13-27-15-17-28(18-16-27)22-11-1-2-12-26-22/h1-2,5-12H,3-4,13-18H2