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

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methyl]-4-[4-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-1-yl]isoindole-1,3-dione Openeye Name: 2-[(2,4-dimethoxyphenyl)methyl]-4-[4-[4-(2-pyridyl)piperazine-1-carbonyl]-1-piperidyl]isoindoline-1,3-dione CAS Name: 2-[(2,4-dimethoxyphenyl)methyl]-4-[4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 2-[(2,4-dimethoxyphenyl)methyl]-4-[4-(4-pyridin-2-ylpiperazine-1-carbonyl)piperidin-1-yl]isoindole-1,3-dione Traditional Name: 2-(2,4-dimethoxybenzyl)-4-[4-[4-(2-pyridyl)piperazine-1-carbonyl]piperidino]isoindoline-1,3-quinone Formula: C32H35N5O5 MolecularWeight: 569.6508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCC(CC4)C(=O)N5CCN(CC5)C6=CC=CC=N6)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCC(CC4)C(=O)N5CCN(CC5)C6=CC=CC=N6)OC

InChI

InChI=1S/C32H35N5O5/c1-41-24-10-9-23(27(20-24)42-2)21-37-31(39)25-6-5-7-26(29(25)32(37)40)34-14-11-22(12-15-34)30(38)36-18-16-35(17-19-36)28-8-3-4-13-33-28/h3-10,13,20,22H,11-12,14-19,21H2,1-2H3