2-[6-oxidanylidene-6-[4-(pyridin-3-ylmethyl)piperazin-1-yl]hexyl]isoindole-1,3-dione

Systemtic Name: 2-[6-oxidanylidene-6-[4-(pyridin-3-ylmethyl)piperazin-1-yl]hexyl]isoindole-1,3-dione Openeye Name: 2-[6-oxo-6-[4-(3-pyridylmethyl)piperazin-1-yl]hexyl]isoindoline-1,3-dione CAS Name: 2-[6-oxo-6-[4-(3-pyridinylmethyl)-1-piperazinyl]hexyl]isoindole-1,3-dione IUPAC Name: 2-[6-oxo-6-[4-(pyridin-3-ylmethyl)piperazin-1-yl]hexyl]isoindole-1,3-dione Traditional Name: 2-[6-keto-6-[4-(3-pyridylmethyl)piperazino]hexyl]isoindoline-1,3-quinone Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C(=O)CCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H28N4O3/c29-22(27-15-13-26(14-16-27)18-19-7-6-11-25-17-19)10-2-1-5-12-28-23(30)20-8-3-4-9-21(20)24(28)31/h3-4,6-9,11,17H,1-2,5,10,12-16,18H2