2-[[4-methoxy-3-[4-(2-methylpropyl)piperazin-1-yl]carbonyl-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-methoxy-3-[4-(2-methylpropyl)piperazin-1-yl]carbonyl-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-(4-isobutylpiperazine-1-carbonyl)-4-methoxy-phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-methoxy-3-[[4-(2-methylpropyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-methoxy-3-[4-(2-methylpropyl)piperazine-1-carbonyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-isobutylpiperazine-1-carbonyl)-4-methoxy-benzyl]isoindoline-1,3-quinone Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C(=O)C2=C(C=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

CC(C)CN1CCN(CC1)C(=O)C2=C(C=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C25H29N3O4/c1-17(2)15-26-10-12-27(13-11-26)23(29)21-14-18(8-9-22(21)32-3)16-28-24(30)19-6-4-5-7-20(19)25(28)31/h4-9,14,17H,10-13,15-16H2,1-3H3