2-[2-oxidanyl-3-[4-oxidanylbutyl-(phenylmethyl)amino]propyl]isoindole-1,3-dione

Systemtic Name: 2-[2-oxidanyl-3-[4-oxidanylbutyl-(phenylmethyl)amino]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[benzyl(4-hydroxybutyl)amino]-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[2-hydroxy-3-[4-hydroxybutyl-(phenylmethyl)amino]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[benzyl(4-hydroxybutyl)amino]-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-[benzyl(4-hydroxybutyl)amino]-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCO)CC(CN2C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCO)CC(CN2C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C22H26N2O4/c25-13-7-6-12-23(14-17-8-2-1-3-9-17)15-18(26)16-24-21(27)19-10-4-5-11-20(19)22(24)28/h1-5,8-11,18,25-26H,6-7,12-16H2