2-methyl-4-[4-(3-pyridin-3-ylpropanoyl)piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-methyl-4-[4-(3-pyridin-3-ylpropanoyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-methyl-4-[4-[3-(3-pyridyl)propanoyl]piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-methyl-4-[4-[1-oxo-3-(3-pyridinyl)propyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-methyl-4-[4-(3-pyridin-3-ylpropanoyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-methyl-4-[4-[3-(3-pyridyl)propanoyl]piperazino]isoindoline-1,3-quinone Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C(=CC=C2)N3CCN(CC3)C(=O)CCC4=CN=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C(=CC=C2)N3CCN(CC3)C(=O)CCC4=CN=CC=C4

InChI

InChI=1S/C21H22N4O3/c1-23-20(27)16-5-2-6-17(19(16)21(23)28)24-10-12-25(13-11-24)18(26)8-7-15-4-3-9-22-14-15/h2-6,9,14H,7-8,10-13H2,1H3