1-[4-chloranyl-2-(trifluoromethyl)phenyl]sulfonyl-4-(phenylmethyl)sulfonyl-piperazine

Systemtic Name: 1-[4-chloranyl-2-(trifluoromethyl)phenyl]sulfonyl-4-(phenylmethyl)sulfonyl-piperazine Openeye Name: 1-benzylsulfonyl-4-[4-chloro-2-(trifluoromethyl)phenyl]sulfonyl-piperazine CAS Name: 1-[4-chloro-2-(trifluoromethyl)phenyl]sulfonyl-4-(phenylmethyl)sulfonylpiperazine IUPAC Name: 1-benzylsulfonyl-4-[4-chloro-2-(trifluoromethyl)phenyl]sulfonylpiperazine Traditional Name: 1-benzylsulfonyl-4-[4-chloro-2-(trifluoromethyl)phenyl]sulfonyl-piperazine Formula: C18H18ClF3N2O4S2 MolecularWeight: 482.92473

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1S(=O)(=O)CC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1S(=O)(=O)CC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C18H18ClF3N2O4S2/c19-15-6-7-17(16(12-15)18(20,21)22)30(27,28)24-10-8-23(9-11-24)29(25,26)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2