1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine hydrochloride

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine hydrochloride Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine hydrochloride CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine hydrochloride IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine hydrochloride Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine hydrochloride Formula: C12H13ClF6N2O2S MolecularWeight: 398.752239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.Cl

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F.Cl

InChI

InChI=1S/C12H12F6N2O2S.ClH/c13-11(14,15)8-5-9(12(16,17)18)7-10(6-8)23(21,22)20-3-1-19-2-4-20;/h5-7,19H,1-4H2;1H