1-(3,4-dimethoxyphenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-4-[4-(trifluoromethyl)benzyl]piperidine Formula: C21H24F3NO4S MolecularWeight: 443.47977

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=C(C=C3)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=C(C=C3)C(F)(F)F)OC

InChI

InChI=1S/C21H24F3NO4S/c1-28-19-8-7-18(14-20(19)29-2)30(26,27)25-11-9-16(10-12-25)13-15-3-5-17(6-4-15)21(22,23)24/h3-8,14,16H,9-13H2,1-2H3