2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Systemtic Name: 2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Openeye Name: 2-[[4-(2-pyridyl)piperazin-1-yl]methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione CAS Name: 2-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione IUPAC Name: 2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione Traditional Name: 2-[[4-(2-pyridyl)piperazino]methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-quinone Formula: C18H24N4O2 MolecularWeight: 328.40876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=O)N(C2=O)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCC2C(C1)C(=O)N(C2=O)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C18H24N4O2/c23-17-14-5-1-2-6-15(14)18(24)22(17)13-20-9-11-21(12-10-20)16-7-3-4-8-19-16/h3-4,7-8,14-15H,1-2,5-6,9-13H2