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

Systemtic Name: 2-[4-[4-(2-chloranylethanoyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Openeye Name: 2-[4-[4-(2-chloroacetyl)piperazin-1-yl]sulfonylphenyl]isoindoline-1,3-dione CAS Name: 2-[4-[[4-(2-chloro-1-oxoethyl)-1-piperazinyl]sulfonyl]phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-[4-(2-chloroacetyl)piperazin-1-yl]sulfonylphenyl]isoindole-1,3-dione Traditional Name: 2-[4-[4-(2-chloroacetyl)piperazino]sulfonylphenyl]isoindoline-1,3-quinone Formula: C20H18ClN3O5S MolecularWeight: 447.89202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCl)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1C(=O)CCl)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H18ClN3O5S/c21-13-18(25)22-9-11-23(12-10-22)30(28,29)15-7-5-14(6-8-15)24-19(26)16-3-1-2-4-17(16)20(24)27/h1-8H,9-13H2