2-[(2-chlorophenyl)methyl]-4-[3-(2-pyridin-3-ylpiperidin-1-yl)carbonylpiperidin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2-chlorophenyl)methyl]-4-[3-(2-pyridin-3-ylpiperidin-1-yl)carbonylpiperidin-1-yl]isoindole-1,3-dione Openeye Name: 2-[(2-chlorophenyl)methyl]-4-[3-[2-(3-pyridyl)piperidine-1-carbonyl]-1-piperidyl]isoindoline-1,3-dione CAS Name: 2-[(2-chlorophenyl)methyl]-4-[3-[oxo-[2-(3-pyridinyl)-1-piperidinyl]methyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 2-[(2-chlorophenyl)methyl]-4-[3-(2-pyridin-3-ylpiperidine-1-carbonyl)piperidin-1-yl]isoindole-1,3-dione Traditional Name: 2-(2-chlorobenzyl)-4-[3-[2-(3-pyridyl)piperidine-1-carbonyl]piperidino]isoindoline-1,3-quinone Formula: C31H31ClN4O3 MolecularWeight: 543.05584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)C(=O)C3CCCN(C3)C4=CC=CC5=C4C(=O)N(C5=O)CC6=CC=CC=C6Cl

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)C(=O)C3CCCN(C3)C4=CC=CC5=C4C(=O)N(C5=O)CC6=CC=CC=C6Cl

InChI

InChI=1S/C31H31ClN4O3/c32-25-12-2-1-8-22(25)20-36-30(38)24-11-5-14-27(28(24)31(36)39)34-16-7-10-23(19-34)29(37)35-17-4-3-13-26(35)21-9-6-15-33-18-21/h1-2,5-6,8-9,11-12,14-15,18,23,26H,3-4,7,10,13,16-17,19-20H2