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

Systemtic Name: 2-[4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(4-chlorophenyl)sulfonylpiperazino]-4-keto-butyl]isoindoline-1,3-quinone Formula: C22H22ClN3O5S MolecularWeight: 475.94518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O5S/c23-16-7-9-17(10-8-16)32(30,31)25-14-12-24(13-15-25)20(27)6-3-11-26-21(28)18-4-1-2-5-19(18)22(26)29/h1-2,4-5,7-10H,3,6,11-15H2