2-[3-oxidanylidene-3-[4-(phenylsulfonyl)piperazin-1-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-oxidanylidene-3-[4-(phenylsulfonyl)piperazin-1-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(benzenesulfonyl)piperazin-1-yl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(benzenesulfonyl)-1-piperazinyl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(benzenesulfonyl)piperazin-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-(4-besylpiperazino)-3-keto-propyl]isoindoline-1,3-quinone Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O5S/c25-19(10-11-24-20(26)17-8-4-5-9-18(17)21(24)27)22-12-14-23(15-13-22)30(28,29)16-6-2-1-3-7-16/h1-9H,10-15H2