4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbaldehyde Openeye Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbaldehyde CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxaldehyde IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbaldehyde Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbaldehyde Formula: C13H12F6N2O3S MolecularWeight: 390.301399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C=O)S(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H12F6N2O3S/c14-12(15,16)9-5-10(13(17,18)19)7-11(6-9)25(23,24)21-3-1-20(8-22)2-4-21/h5-8H,1-4H2