2-[[3-(2-oxidanylidenepiperazin-1-yl)phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-(2-oxidanylidenepiperazin-1-yl)phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(2-oxopiperazin-1-yl)phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-(2-oxo-1-piperazinyl)phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-(2-oxopiperazin-1-yl)phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(2-ketopiperazino)benzyl]isoindoline-1,3-quinone Formula: C19H17N3O3 MolecularWeight: 335.35658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1)C2=CC=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(C(=O)CN1)C2=CC=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H17N3O3/c23-17-11-20-8-9-21(17)14-5-3-4-13(10-14)12-22-18(24)15-6-1-2-7-16(15)19(22)25/h1-7,10,20H,8-9,11-12H2