1-(4-fluorophenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(4-fluorophenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(4-fluorophenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(4-fluorophenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(4-fluorophenyl)sulfonyl-4-[4-nitro-2-(trifluoromethyl)phenyl]piperazine Formula: C17H15F4N3O4S MolecularWeight: 433.377313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15F4N3O4S/c18-12-1-4-14(5-2-12)29(27,28)23-9-7-22(8-10-23)16-6-3-13(24(25)26)11-15(16)17(19,20)21/h1-6,11H,7-10H2