N-[3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-4-nitro-benzamide

Systemtic Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-4-nitro-benzamide Openeye Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-4-nitro-benzamide CAS Name: N-[3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]propyl]-4-nitrobenzamide IUPAC Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-4-nitrobenzamide Traditional Name: N-[3-[4-(4-fluorophenyl)piperazino]sulfonylpropyl]-4-nitro-benzamide Formula: C20H23FN4O5S MolecularWeight: 450.483823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)CCCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)CCCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23FN4O5S/c21-17-4-8-18(9-5-17)23-11-13-24(14-12-23)31(29,30)15-1-10-22-20(26)16-2-6-19(7-3-16)25(27)28/h2-9H,1,10-15H2,(H,22,26)