3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-3H-isoindol-1-one

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-3H-isoindol-1-one Openeye Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-isoindolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-methyl-3H-isoindol-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-methyl-3H-isoindol-1-one Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-2-methyl-isoindolin-1-one Formula: C28H31N3O MolecularWeight: 425.56524

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2=CC=CC=C2C1=O)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C(C2=CC=CC=C2C1=O)N3CCN(CC3)CCC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31N3O/c1-29-27(25-14-8-9-15-26(25)28(29)32)31-20-18-30(19-21-31)17-16-24(22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-15,24,27H,16-21H2,1H3