1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(2,5-diethoxy-4-methylphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(2,5-diethoxy-4-methylphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(2,5-diethoxy-4-methyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C22H27F3N2O4S MolecularWeight: 472.52099

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C)OCC)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC(=C(C=C1C)OCC)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H27F3N2O4S/c1-4-30-19-15-21(20(31-5-2)13-16(19)3)32(28,29)27-11-9-26(10-12-27)18-8-6-7-17(14-18)22(23,24)25/h6-8,13-15H,4-5,9-12H2,1-3H3