4-[4-[4-(4-methylphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-(pyridin-3-ylmethyl)isoindole-1,3-dione

Systemtic Name: 4-[4-[4-(4-methylphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-(pyridin-3-ylmethyl)isoindole-1,3-dione Openeye Name: 4-[4-[4-(p-tolyl)piperazine-1-carbonyl]-1-piperidyl]-2-(3-pyridylmethyl)isoindoline-1,3-dione CAS Name: 4-[4-[[4-(4-methylphenyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-(3-pyridinylmethyl)isoindole-1,3-dione IUPAC Name: 4-[4-[4-(4-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl]-2-(pyridin-3-ylmethyl)isoindole-1,3-dione Traditional Name: 4-[4-[4-(p-tolyl)piperazine-1-carbonyl]piperidino]-2-(3-pyridylmethyl)isoindoline-1,3-quinone Formula: C31H33N5O3 MolecularWeight: 523.62542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)C4=CC=CC5=C4C(=O)N(C5=O)CC6=CN=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCN(CC3)C4=CC=CC5=C4C(=O)N(C5=O)CC6=CN=CC=C6

InChI

InChI=1S/C31H33N5O3/c1-22-7-9-25(10-8-22)33-16-18-35(19-17-33)29(37)24-11-14-34(15-12-24)27-6-2-5-26-28(27)31(39)36(30(26)38)21-23-4-3-13-32-20-23/h2-10,13,20,24H,11-12,14-19,21H2,1H3