1-[5-[3-(4-naphthalen-1-ylpiperazin-1-yl)propoxy]-1,3-dihydroisoindol-2-yl]ethanone

Systemtic Name: 1-[5-[3-(4-naphthalen-1-ylpiperazin-1-yl)propoxy]-1,3-dihydroisoindol-2-yl]ethanone Openeye Name: 1-[5-[3-[4-(1-naphthyl)piperazin-1-yl]propoxy]isoindolin-2-yl]ethanone CAS Name: 1-[5-[3-[4-(1-naphthalenyl)-1-piperazinyl]propoxy]-1,3-dihydroisoindol-2-yl]ethanone IUPAC Name: 1-[5-[3-(4-naphthalen-1-ylpiperazin-1-yl)propoxy]-1,3-dihydroisoindol-2-yl]ethanone Traditional Name: 1-[5-[3-[4-(1-naphthyl)piperazino]propoxy]isoindolin-2-yl]ethanone Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C1)C=C(C=C2)OCCCN3CCN(CC3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(=O)N1CC2=C(C1)C=C(C=C2)OCCCN3CCN(CC3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H31N3O2/c1-21(31)30-19-23-10-11-25(18-24(23)20-30)32-17-5-12-28-13-15-29(16-14-28)27-9-4-7-22-6-2-3-8-26(22)27/h2-4,6-11,18H,5,12-17,19-20H2,1H3