1,3-benzodioxol-5-yl-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-[4-chloro-3-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C19H16ClF3N2O5S MolecularWeight: 476.85395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C19H16ClF3N2O5S/c20-15-3-2-13(10-14(15)19(21,22)23)31(27,28)25-7-5-24(6-8-25)18(26)12-1-4-16-17(9-12)30-11-29-16/h1-4,9-10H,5-8,11H2