2-cyclohexyl-5-[phenethyl(propyl)amino]-2-[2-(trifluoromethyl)phenyl]heptanenitrile

Systemtic Name: 2-cyclohexyl-5-[phenethyl(propyl)amino]-2-[2-(trifluoromethyl)phenyl]heptanenitrile Openeye Name: 2-cyclohexyl-5-[phenethyl(propyl)amino]-2-[2-(trifluoromethyl)phenyl]heptanenitrile CAS Name: 2-cyclohexyl-5-[phenethyl(propyl)amino]-2-[2-(trifluoromethyl)phenyl]heptanenitrile IUPAC Name: 2-cyclohexyl-5-[phenethyl(propyl)amino]-2-[2-(trifluoromethyl)phenyl]heptanenitrile Traditional Name: 2-cyclohexyl-5-[phenethyl(propyl)amino]-2-[2-(trifluoromethyl)phenyl]enanthonitrile Formula: C31H41F3N2 MolecularWeight: 498.66585

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC1=CC=CC=C1)C(CC)CCC(C#N)(C2CCCCC2)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCCN(CCC1=CC=CC=C1)C(CC)CCC(C#N)(C2CCCCC2)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C31H41F3N2/c1-3-22-36(23-20-25-13-7-5-8-14-25)27(4-2)19-21-30(24-35,26-15-9-6-10-16-26)28-17-11-12-18-29(28)31(32,33)34/h5,7-8,11-14,17-18,26-27H,3-4,6,9-10,15-16,19-23H2,1-2H3