2-[2-(3-oxidanylidene-1-phenacyl-piperazin-2-yl)phenyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(3-oxidanylidene-1-phenacyl-piperazin-2-yl)phenyl]isoindole-1,3-dione Openeye Name: 2-[2-(3-oxo-1-phenacyl-piperazin-2-yl)phenyl]isoindoline-1,3-dione CAS Name: 2-[2-(3-oxo-1-phenacyl-2-piperazinyl)phenyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3-oxo-1-phenacylpiperazin-2-yl)phenyl]isoindole-1,3-dione Traditional Name: 2-[2-(3-keto-1-phenacyl-piperazin-2-yl)phenyl]isoindoline-1,3-quinone Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)C2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O)CC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(C(C(=O)N1)C2=CC=CC=C2N3C(=O)C4=CC=CC=C4C3=O)CC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O4/c30-22(17-8-2-1-3-9-17)16-28-15-14-27-24(31)23(28)20-12-6-7-13-21(20)29-25(32)18-10-4-5-11-19(18)26(29)33/h1-13,23H,14-16H2,(H,27,31)