2-[4-[4-(2-chloroethyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[4-(2-chloroethyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(2-chloroethyl)piperazin-1-yl]sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[[4-(2-chloroethyl)-1-piperazinyl]sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(2-chloroethyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(2-chloroethyl)piperazino]sulfonylphenyl]isoindoline-1,3-quinone Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCl)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1CCCl)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H20ClN3O4S/c21-9-10-22-11-13-23(14-12-22)29(27,28)16-7-5-15(6-8-16)24-19(25)17-3-1-2-4-18(17)20(24)26/h1-8H,9-14H2