2-[[3-[4-(2-methylpropanoyl)piperazin-1-yl]carbonylphenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-[4-(2-methylpropanoyl)piperazin-1-yl]carbonylphenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-isobutyrylpiperazine-1-carbonyl)benzyl]isoindoline-1,3-quinone Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=CC=C2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25N3O4/c1-16(2)21(28)25-10-12-26(13-11-25)22(29)18-7-5-6-17(14-18)15-27-23(30)19-8-3-4-9-20(19)24(27)31/h3-9,14,16H,10-13,15H2,1-2H3