3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]thiolane 1,1-dioxide

Systemtic Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]thiolane 1,1-dioxide Openeye Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]thiolane 1,1-dioxide CAS Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]thiolane 1,1-dioxide IUPAC Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]thiolane 1,1-dioxide Traditional Name: 3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]sulfolane Formula: C15H18F3N3O4S MolecularWeight: 393.38133

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CS(=O)(=O)CC1N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H18F3N3O4S/c16-15(17,18)11-1-2-13(14(9-11)21(22)23)20-6-4-19(5-7-20)12-3-8-26(24,25)10-12/h1-2,9,12H,3-8,10H2