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

Systemtic Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(4-fluorophenyl)-3H-isoindol-1-one Openeye Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(4-fluorophenyl)isoindolin-1-one CAS Name: 3-[4-(3,3-diphenylpropyl)-1-piperazinyl]-2-(4-fluorophenyl)-3H-isoindol-1-one IUPAC Name: 3-[4-(3,3-diphenylpropyl)piperazin-1-yl]-2-(4-fluorophenyl)-3H-isoindol-1-one Traditional Name: 3-[4-(3,3-diphenylpropyl)piperazino]-2-(4-fluorophenyl)isoindolin-1-one Formula: C33H32FN3O MolecularWeight: 505.625083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4C5=CC=CC=C5C(=O)N4C6=CC=C(C=C6)F

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4C5=CC=CC=C5C(=O)N4C6=CC=C(C=C6)F

InChI

InChI=1S/C33H32FN3O/c34-27-15-17-28(18-16-27)37-32(30-13-7-8-14-31(30)33(37)38)36-23-21-35(22-24-36)20-19-29(25-9-3-1-4-10-25)26-11-5-2-6-12-26/h1-18,29,32H,19-24H2