2-[2-oxidanyl-3-[4-(phenylmethyl)piperazin-1-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[2-oxidanyl-3-[4-(phenylmethyl)piperazin-1-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-(4-benzylpiperazin-1-yl)-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[2-hydroxy-3-[4-(phenylmethyl)-1-piperazinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(4-benzylpiperazin-1-yl)-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-benzylpiperazino)-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(CN3C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(CN3C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C22H25N3O3/c26-18(16-25-21(27)19-8-4-5-9-20(19)22(25)28)15-24-12-10-23(11-13-24)14-17-6-2-1-3-7-17/h1-9,18,26H,10-16H2