5-[4-(4-naphthalen-1-ylpiperazin-1-yl)butoxy]-2,3-dihydroisoindol-1-one

Systemtic Name: 5-[4-(4-naphthalen-1-ylpiperazin-1-yl)butoxy]-2,3-dihydroisoindol-1-one Openeye Name: 5-[4-[4-(1-naphthyl)piperazin-1-yl]butoxy]isoindolin-1-one CAS Name: 5-[4-[4-(1-naphthalenyl)-1-piperazinyl]butoxy]-2,3-dihydroisoindol-1-one IUPAC Name: 5-[4-(4-naphthalen-1-ylpiperazin-1-yl)butoxy]-2,3-dihydroisoindol-1-one Traditional Name: 5-[4-[4-(1-naphthyl)piperazino]butoxy]isoindolin-1-one Formula: C26H29N3O2 MolecularWeight: 415.52736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=CC3=C(C=C2)C(=O)NC3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCCCOC2=CC3=C(C=C2)C(=O)NC3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H29N3O2/c30-26-24-11-10-22(18-21(24)19-27-26)31-17-4-3-12-28-13-15-29(16-14-28)25-9-5-7-20-6-1-2-8-23(20)25/h1-2,5-11,18H,3-4,12-17,19H2,(H,27,30)