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

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine Traditional Name: 1-(2,5-dimethoxybenzyl)-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine Formula: C20H23F3N2O4S MolecularWeight: 444.46783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H23F3N2O4S/c1-28-17-5-8-19(29-2)15(13-17)14-24-9-11-25(12-10-24)30(26,27)18-6-3-16(4-7-18)20(21,22)23/h3-8,13H,9-12,14H2,1-2H3