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

Systemtic Name: 6-[4-[4-(6-fluoranylnaphthalen-1-yl)piperazin-1-yl]butyl]-2,3-dihydroisoindol-1-one Openeye Name: 6-[4-[4-(6-fluoro-1-naphthyl)piperazin-1-yl]butyl]isoindolin-1-one CAS Name: 6-[4-[4-(6-fluoro-1-naphthalenyl)-1-piperazinyl]butyl]-2,3-dihydroisoindol-1-one IUPAC Name: 6-[4-[4-(6-fluoronaphthalen-1-yl)piperazin-1-yl]butyl]-2,3-dihydroisoindol-1-one Traditional Name: 6-[4-[4-(6-fluoro-1-naphthyl)piperazino]butyl]isoindolin-1-one Formula: C26H28FN3O MolecularWeight: 417.518423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC3=C(CNC3=O)C=C2)C4=CC=CC5=C4C=CC(=C5)F

Isomeric SMILES

C1CN(CCN1CCCCC2=CC3=C(CNC3=O)C=C2)C4=CC=CC5=C4C=CC(=C5)F

InChI

InChI=1S/C26H28FN3O/c27-22-9-10-23-20(17-22)5-3-6-25(23)30-14-12-29(13-15-30)11-2-1-4-19-7-8-21-18-28-26(31)24(21)16-19/h3,5-10,16-17H,1-2,4,11-15,18H2,(H,28,31)