2-[(4-bromophenyl)methyl]-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one

Systemtic Name: 2-[(4-bromophenyl)methyl]-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-[(4-bromophenyl)methyl]-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]isoindolin-1-one CAS Name: 2-[(4-bromophenyl)methyl]-6-[4-(3,3-diphenylpropyl)-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-[(4-bromophenyl)methyl]-6-[4-(3,3-diphenylpropyl)piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-(4-bromobenzyl)-6-[4-(3,3-diphenylpropyl)piperazino]isoindolin-1-one Formula: C34H34BrN3O MolecularWeight: 580.55726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(CN(C5=O)CC6=CC=C(C=C6)Br)C=C4

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(CN(C5=O)CC6=CC=C(C=C6)Br)C=C4

InChI

InChI=1S/C34H34BrN3O/c35-30-14-11-26(12-15-30)24-38-25-29-13-16-31(23-33(29)34(38)39)37-21-19-36(20-22-37)18-17-32(27-7-3-1-4-8-27)28-9-5-2-6-10-28/h1-16,23,32H,17-22,24-25H2