2-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(1-pyrimidin-2-yl-4-piperidyl)methyl]isoindoline-1,3-dione CAS Name: 2-[[1-(2-pyrimidinyl)-4-piperidinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[[1-(2-pyrimidyl)-4-piperidyl]methyl]isoindoline-1,3-quinone Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)C3=CC=CC=C3C2=O)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1CN2C(=O)C3=CC=CC=C3C2=O)C4=NC=CC=N4

InChI

InChI=1S/C18H18N4O2/c23-16-14-4-1-2-5-15(14)17(24)22(16)12-13-6-10-21(11-7-13)18-19-8-3-9-20-18/h1-5,8-9,13H,6-7,10-12H2