3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-2,3-dihydroisoindol-1-one

Systemtic Name: 3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-2,3-dihydroisoindol-1-one Openeye Name: 3-[2-[4-(p-tolyl)piperazin-1-yl]ethyl]isoindolin-1-one CAS Name: 3-[2-[4-(4-methylphenyl)-1-piperazinyl]ethyl]-2,3-dihydroisoindol-1-one IUPAC Name: 3-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-2,3-dihydroisoindol-1-one Traditional Name: 3-[2-[4-(p-tolyl)piperazino]ethyl]isoindolin-1-one Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C21H25N3O/c1-16-6-8-17(9-7-16)24-14-12-23(13-15-24)11-10-20-18-4-2-3-5-19(18)21(25)22-20/h2-9,20H,10-15H2,1H3,(H,22,25)