2-[2-(4-chlorophenyl)sulfonylethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(4-chlorophenyl)sulfonylethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(4-chlorophenyl)sulfonylethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(4-chlorophenyl)sulfonylethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(4-chlorophenyl)sulfonylethyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(4-chlorophenyl)sulfonylethyl]-5-nitro-isoindoline-1,3-quinone Formula: C16H11ClN2O6S MolecularWeight: 394.78634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H11ClN2O6S/c17-10-1-4-12(5-2-10)26(24,25)8-7-18-15(20)13-6-3-11(19(22)23)9-14(13)16(18)21/h1-6,9H,7-8H2