5-[bis(phenylmethyl)amino]-2-cyclobutyl-2-[4-(trifluoromethyl)phenyl]heptanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-cyclobutyl-2-[4-(trifluoromethyl)phenyl]heptanenitrile Openeye Name: 2-cyclobutyl-5-(dibenzylamino)-2-[4-(trifluoromethyl)phenyl]heptanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-cyclobutyl-2-[4-(trifluoromethyl)phenyl]heptanenitrile IUPAC Name: 2-cyclobutyl-5-(dibenzylamino)-2-[4-(trifluoromethyl)phenyl]heptanenitrile Traditional Name: 2-cyclobutyl-5-(dibenzylamino)-2-[4-(trifluoromethyl)phenyl]enanthonitrile Formula: C32H35F3N2 MolecularWeight: 504.62891

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1CCC1)C2=CC=C(C=C2)C(F)(F)F)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC(CCC(C#N)(C1CCC1)C2=CC=C(C=C2)C(F)(F)F)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C32H35F3N2/c1-2-30(37(22-25-10-5-3-6-11-25)23-26-12-7-4-8-13-26)20-21-31(24-36,27-14-9-15-27)28-16-18-29(19-17-28)32(33,34)35/h3-8,10-13,16-19,27,30H,2,9,14-15,20-23H2,1H3