N-[2-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylethyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylethyl]-2-nitro-benzenesulfonamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylethyl]-2-nitro-benzenesulfonamide CAS Name: N-[2-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]ethyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylethyl]-2-nitrobenzenesulfonamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazino]sulfonylethyl]-2-nitro-benzenesulfonamide Formula: C18H21FN4O6S2 MolecularWeight: 472.510943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)CCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)CCNS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H21FN4O6S2/c19-15-5-1-2-6-16(15)21-10-12-22(13-11-21)30(26,27)14-9-20-31(28,29)18-8-4-3-7-17(18)23(24)25/h1-8,20H,9-14H2