2-(3-methylbutyl)-5-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(3-methylbutyl)-5-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-isopentyl-5-[4-(o-tolyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-(3-methylbutyl)-5-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-(3-methylbutyl)-5-[4-(2-methylphenyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-isoamyl-5-[4-(o-tolyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CCC(C)C

InChI

InChI=1S/C25H29N3O3/c1-17(2)10-11-28-24(30)20-9-8-19(16-21(20)25(28)31)23(29)27-14-12-26(13-15-27)22-7-5-4-6-18(22)3/h4-9,16-17H,10-15H2,1-3H3