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

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-4-(phenylsulfonyl)piperazine Openeye Name: 1-(benzenesulfonyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(benzenesulfonyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(benzenesulfonyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-besyl-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine Formula: C17H16F3N3O4S MolecularWeight: 415.38685

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16F3N3O4S/c18-17(19,20)13-6-7-15(16(12-13)23(24)25)21-8-10-22(11-9-21)28(26,27)14-4-2-1-3-5-14/h1-7,12H,8-11H2