3-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzenecarbonitrile

Systemtic Name: 3-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzenecarbonitrile Openeye Name: 3-[3-[(4-phenyl-4-piperidyl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzonitrile CAS Name: 3-[3-[(4-phenyl-4-piperidinyl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzonitrile IUPAC Name: 3-[3-[(4-phenylpiperidin-4-yl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzonitrile Traditional Name: 3-[3-[(4-phenyl-4-piperidyl)methoxymethyl]-5-(trifluoromethyl)phenyl]benzonitrile Formula: C27H25F3N2O MolecularWeight: 450.49541

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(COCC2=CC(=CC(=C2)C3=CC=CC(=C3)C#N)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CNCCC1(COCC2=CC(=CC(=C2)C3=CC=CC(=C3)C#N)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C27H25F3N2O/c28-27(29,30)25-15-21(14-23(16-25)22-6-4-5-20(13-22)17-31)18-33-19-26(9-11-32-12-10-26)24-7-2-1-3-8-24/h1-8,13-16,32H,9-12,18-19H2