5-[ethyl(phenethyl)amino]-2-propan-2-yl-2-[2-(trifluoromethyl)phenyl]heptanenitrile

Systemtic Name: 5-[ethyl(phenethyl)amino]-2-propan-2-yl-2-[2-(trifluoromethyl)phenyl]heptanenitrile Openeye Name: 5-[ethyl(phenethyl)amino]-2-isopropyl-2-[2-(trifluoromethyl)phenyl]heptanenitrile CAS Name: 5-[ethyl(phenethyl)amino]-2-propan-2-yl-2-[2-(trifluoromethyl)phenyl]heptanenitrile IUPAC Name: 5-[ethyl(phenethyl)amino]-2-propan-2-yl-2-[2-(trifluoromethyl)phenyl]heptanenitrile Traditional Name: 5-[ethyl(phenethyl)amino]-2-isopropyl-2-[2-(trifluoromethyl)phenyl]enanthonitrile Formula: C27H35F3N2 MolecularWeight: 444.57541

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1=CC=CC=C1C(F)(F)F)C(C)C)N(CC)CCC2=CC=CC=C2

Isomeric SMILES

CCC(CCC(C#N)(C1=CC=CC=C1C(F)(F)F)C(C)C)N(CC)CCC2=CC=CC=C2

InChI

InChI=1S/C27H35F3N2/c1-5-23(32(6-2)19-17-22-12-8-7-9-13-22)16-18-26(20-31,21(3)4)24-14-10-11-15-25(24)27(28,29)30/h7-15,21,23H,5-6,16-19H2,1-4H3