4-methoxy-N-methyl-N-phenethyl-3-[4-[2,2,2-tris(chloranyl)ethanoyl]piperazin-1-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-[2,2,2-tris(chloranyl)ethanoyl]piperazin-1-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-(2,2,2-trichloroacetyl)piperazin-1-yl]benzenesulfonamide CAS Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-(2,2,2-trichloro-1-oxoethyl)-1-piperazinyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-(2,2,2-trichloroacetyl)piperazin-1-yl]benzenesulfonamide Traditional Name: 4-methoxy-N-methyl-N-phenethyl-3-[4-(2,2,2-trichloroacetyl)piperazino]benzenesulfonamide Formula: C22H26Cl3N3O4S MolecularWeight: 534.88354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)C(Cl)(Cl)Cl

Isomeric SMILES

CN(CCC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)N3CCN(CC3)C(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C22H26Cl3N3O4S/c1-26(11-10-17-6-4-3-5-7-17)33(30,31)18-8-9-20(32-2)19(16-18)27-12-14-28(15-13-27)21(29)22(23,24)25/h3-9,16H,10-15H2,1-2H3