2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-[4-(2-nitrophenyl)sulfonylpiperazino]ethyl]isoindoline-1,3-quinone Formula: C20H18N4O7S MolecularWeight: 458.44452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O7S/c25-18(13-23-19(26)14-5-1-2-6-15(14)20(23)27)21-9-11-22(12-10-21)32(30,31)17-8-4-3-7-16(17)24(28)29/h1-8H,9-13H2