1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine

Systemtic Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Openeye Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine CAS Name: 1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine IUPAC Name: 1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Traditional Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-[3-(trifluoromethyl)phenyl]piperazine Formula: C21H25F3N2O3S MolecularWeight: 442.49501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C)C)OC

InChI

InChI=1S/C21H25F3N2O3S/c1-14-12-19(29-4)15(2)16(3)20(14)30(27,28)26-10-8-25(9-11-26)18-7-5-6-17(13-18)21(22,23)24/h5-7,12-13H,8-11H2,1-4H3