2-butyl-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-butyl-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione Openeye Name: 2-butyl-5-(4-phenylpiperazine-1-carbonyl)isoindoline-1,3-dione CAS Name: 2-butyl-5-[oxo-(4-phenyl-1-piperazinyl)methyl]isoindole-1,3-dione IUPAC Name: 2-butyl-5-(4-phenylpiperazine-1-carbonyl)isoindole-1,3-dione Traditional Name: 2-butyl-5-(4-phenylpiperazine-1-carbonyl)isoindoline-1,3-quinone Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O3/c1-2-3-11-26-22(28)19-10-9-17(16-20(19)23(26)29)21(27)25-14-12-24(13-15-25)18-7-5-4-6-8-18/h4-10,16H,2-3,11-15H2,1H3