5-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(2-hydroxyphenyl)piperazin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione Openeye Name: 2-benzyl-5-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 5-[[4-(2-hydroxyphenyl)-1-piperazinyl]-oxomethyl]-2-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 2-benzyl-5-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-benzyl-5-[4-(2-hydroxyphenyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2O)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2O)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O4/c30-23-9-5-4-8-22(23)27-12-14-28(15-13-27)24(31)19-10-11-20-21(16-19)26(33)29(25(20)32)17-18-6-2-1-3-7-18/h1-11,16,30H,12-15,17H2