1-(3,4-diethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(3,4-diethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(3,4-diethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(3,4-diethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(3,4-diethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(3,4-diethoxyphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C21H25F3N2O4S MolecularWeight: 458.49441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)OCC

InChI

InChI=1S/C21H25F3N2O4S/c1-3-29-19-9-8-18(15-20(19)30-4-2)31(27,28)26-12-10-25(11-13-26)17-7-5-6-16(14-17)21(22,23)24/h5-9,14-15H,3-4,10-13H2,1-2H3