2-[4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(3-chlorophenyl)sulfonylpiperazino]butyl]isoindoline-1,3-quinone Formula: C22H24ClN3O4S MolecularWeight: 461.96166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H24ClN3O4S/c23-17-6-5-7-18(16-17)31(29,30)25-14-12-24(13-15-25)10-3-4-11-26-21(27)19-8-1-2-9-20(19)22(26)28/h1-2,5-9,16H,3-4,10-15H2