2-butyl-5-(4-pyridin-4-ylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-butyl-5-(4-pyridin-4-ylpiperazin-1-yl)carbonyl-isoindole-1,3-dione Openeye Name: 2-butyl-5-[4-(4-pyridyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-butyl-5-[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]isoindole-1,3-dione IUPAC Name: 2-butyl-5-(4-pyridin-4-ylpiperazine-1-carbonyl)isoindole-1,3-dione Traditional Name: 2-butyl-5-[4-(4-pyridyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C22H24N4O3/c1-2-3-10-26-21(28)18-5-4-16(15-19(18)22(26)29)20(27)25-13-11-24(12-14-25)17-6-8-23-9-7-17/h4-9,15H,2-3,10-14H2,1H3