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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCC(C(C1)COC2=CC=CC(=C2)C(F)(F)F)C3=CSC=C3

Isomeric SMILES

CC(C)CCN1CCC(C(C1)COC2=CC=CC(=C2)C(F)(F)F)C3=CSC=C3

InChI

InChI=1S/C22H28F3NOS/c1-16(2)6-9-26-10-7-21(17-8-11-28-15-17)18(13-26)14-27-20-5-3-4-19(12-20)22(23,24)25/h3-5,8,11-12,15-16,18,21H,6-7,9-10,13-14H2,1-2H3