1-(2-methylbutyl)-4-thiophen-3-yl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine

Systemtic Name: 1-(2-methylbutyl)-4-thiophen-3-yl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine Openeye Name: 1-(2-methylbutyl)-4-(3-thienyl)-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine CAS Name: 1-(2-methylbutyl)-4-(3-thiophenyl)-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine IUPAC Name: 1-(2-methylbutyl)-4-thiophen-3-yl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine Traditional Name: 1-(2-methylbutyl)-4-(3-thienyl)-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidine Formula: C22H28F3NOS MolecularWeight: 411.52403

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1CCC(C(C1)COC2=CC=C(C=C2)C(F)(F)F)C3=CSC=C3

Isomeric SMILES

CCC(C)CN1CCC(C(C1)COC2=CC=C(C=C2)C(F)(F)F)C3=CSC=C3

InChI

InChI=1S/C22H28F3NOS/c1-3-16(2)12-26-10-8-21(17-9-11-28-15-17)18(13-26)14-27-20-6-4-19(5-7-20)22(23,24)25/h4-7,9,11,15-16,18,21H,3,8,10,12-14H2,1-2H3