2-butyl-5-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-butyl-5-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-butyl-5-[4-(2,4-dichlorobenzoyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-butyl-5-[[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-butyl-5-[4-(2,4-dichlorobenzoyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-butyl-5-[4-(2,4-dichlorobenzoyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C24H23Cl2N3O4 MolecularWeight: 488.36312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C24H23Cl2N3O4/c1-2-3-8-29-23(32)17-6-4-15(13-19(17)24(29)33)21(30)27-9-11-28(12-10-27)22(31)18-7-5-16(25)14-20(18)26/h4-7,13-14H,2-3,8-12H2,1H3