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5-[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonyl-2-(4-methylphenyl)isoindole-1,3-dione
SpectraBase Compound ID 42m0pKk1ydx
InChI InChI=1S/C26H21Cl2N3O3/c1-16-2-5-18(6-3-16)31-25(33)20-8-4-17(14-21(20)26(31)34)24(32)30-12-10-29(11-13-30)19-7-9-22(27)23(28)15-19/h2-9,14-15H,10-13H2,1H3
InChIKey IIBMYGWTCNTEAB-UHFFFAOYSA-N
Mol Weight 494.38 g/mol
Molecular Formula C26H21Cl2N3O3
Exact Mass 493.095997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1U1NooNnMsU
Name 5-[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonyl-2-(4-methylphenyl)isoindole-1,3-dione
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Formula C26H21Cl2N3O3
InChI InChI=1S/C26H21Cl2N3O3/c1-16-2-5-18(6-3-16)31-25(33)20-8-4-17(14-21(20)26(31)34)24(32)30-12-10-29(11-13-30)19-7-9-22(27)23(28)15-19/h2-9,14-15H,10-13H2,1H3
InChIKey IIBMYGWTCNTEAB-UHFFFAOYSA-N
Molecular Weight 494.378 g/mol
SMILES c1c(c(ccc1N1CCN(CC1)C(=O)c1ccc2c(C(=O)N(C2=O)c2ccc(C)cc2)c1)Cl)Cl
SPLASH splash10-0udi-6890100000-79b2573f8f6c91abaf54
Synonyms 5-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2-(4-methylphenyl)isoindole-1,3-dione 5-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2-(p-tolyl)isoindoline-1,3-dione 5-[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]-2-(p-tolyl)isoindoline-1,3-quinone 5-[[4-(3,4-dichlorophenyl)-1-piperazinyl]-oxomethyl]-2-(4-methylphenyl)isoindole-1,3-dione 5-{[4-(3,4-dichlorophenyl)-1-piperazinyl]carbonyl}-2-(4-methylphenyl)-1H-isoindole-1,3(2H)-dione
Wiley ID 1444652