(3-methoxy-4-propan-2-yloxy-phenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-methoxy-4-propan-2-yloxy-phenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (4-isopropoxy-3-methoxy-phenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (3-methoxy-4-propan-2-yloxyphenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-methoxy-4-propan-2-yloxyphenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (4-isopropoxy-3-methoxy-phenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C22H25F3N2O5S MolecularWeight: 486.50451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F)OC

InChI

InChI=1S/C22H25F3N2O5S/c1-15(2)32-19-9-4-16(14-20(19)31-3)21(28)26-10-12-27(13-11-26)33(29,30)18-7-5-17(6-8-18)22(23,24)25/h4-9,14-15H,10-13H2,1-3H3