6-[4-[4-(2,3-dihydro-1H-inden-4-yl)piperazin-1-yl]butyl]-2,3-dihydroisoindol-1-one

Systemtic Name: 6-[4-[4-(2,3-dihydro-1H-inden-4-yl)piperazin-1-yl]butyl]-2,3-dihydroisoindol-1-one Openeye Name: 6-[4-(4-indan-4-ylpiperazin-1-yl)butyl]isoindolin-1-one CAS Name: 6-[4-[4-(2,3-dihydro-1H-inden-4-yl)-1-piperazinyl]butyl]-2,3-dihydroisoindol-1-one IUPAC Name: 6-[4-[4-(2,3-dihydro-1H-inden-4-yl)piperazin-1-yl]butyl]-2,3-dihydroisoindol-1-one Traditional Name: 6-[4-(4-indan-4-ylpiperazino)butyl]isoindolin-1-one Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C(=CC=C2)N3CCN(CC3)CCCCC4=CC5=C(CNC5=O)C=C4

Isomeric SMILES

C1CC2=C(C1)C(=CC=C2)N3CCN(CC3)CCCCC4=CC5=C(CNC5=O)C=C4

InChI

InChI=1S/C25H31N3O/c29-25-23-17-19(10-11-21(23)18-26-25)5-1-2-12-27-13-15-28(16-14-27)24-9-4-7-20-6-3-8-22(20)24/h4,7,9-11,17H,1-3,5-6,8,12-16,18H2,(H,26,29)