1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(2-nitro-4-piperidin-1-ylsulfonylphenyl)-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(2-nitro-4-piperidinosulfonyl-phenyl)-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C22H25F3N4O4S MolecularWeight: 498.51851

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H25F3N4O4S/c23-22(24,25)17-5-4-6-18(15-17)26-11-13-27(14-12-26)20-8-7-19(16-21(20)29(30)31)34(32,33)28-9-2-1-3-10-28/h4-8,15-16H,1-3,9-14H2