2-[[2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2-[[4-(2-methoxyphenyl)-1-piperazinyl]methyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[2-[[4-(2-methoxyphenyl)piperazino]methyl]benzyl]isoindoline-1,3-quinone Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC3=CC=CC=C3CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC3=CC=CC=C3CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H27N3O3/c1-33-25-13-7-6-12-24(25)29-16-14-28(15-17-29)18-20-8-2-3-9-21(20)19-30-26(31)22-10-4-5-11-23(22)27(30)32/h2-13H,14-19H2,1H3