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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C3=CC=CC=C3F

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])C3=CC=CC=C3F

InChI

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