4-[1-pentyl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[1-pentyl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-4-yl]benzenecarbonitrile Openeye Name: 4-[1-pentyl-3-[[4-(trifluoromethyl)phenoxy]methyl]-4-piperidyl]benzonitrile CAS Name: 4-[1-pentyl-3-[[4-(trifluoromethyl)phenoxy]methyl]-4-piperidinyl]benzonitrile IUPAC Name: 4-[1-pentyl-3-[[4-(trifluoromethyl)phenoxy]methyl]piperidin-4-yl]benzonitrile Traditional Name: 4-[1-amyl-3-[[4-(trifluoromethyl)phenoxy]methyl]-4-piperidyl]benzonitrile Formula: C25H29F3N2O MolecularWeight: 430.50577

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(C(C1)COC2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCN1CCC(C(C1)COC2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H29F3N2O/c1-2-3-4-14-30-15-13-24(20-7-5-19(16-29)6-8-20)21(17-30)18-31-23-11-9-22(10-12-23)25(26,27)28/h5-12,21,24H,2-4,13-15,17-18H2,1H3