5-[ethyl-(phenylmethyl)amino]-2-propan-2-yl-2-[4-(trifluoromethyl)phenyl]heptanenitrile

Systemtic Name: 5-[ethyl-(phenylmethyl)amino]-2-propan-2-yl-2-[4-(trifluoromethyl)phenyl]heptanenitrile Openeye Name: 5-[benzyl(ethyl)amino]-2-isopropyl-2-[4-(trifluoromethyl)phenyl]heptanenitrile CAS Name: 5-[ethyl-(phenylmethyl)amino]-2-propan-2-yl-2-[4-(trifluoromethyl)phenyl]heptanenitrile IUPAC Name: 5-[benzyl(ethyl)amino]-2-propan-2-yl-2-[4-(trifluoromethyl)phenyl]heptanenitrile Traditional Name: 5-[benzyl(ethyl)amino]-2-isopropyl-2-[4-(trifluoromethyl)phenyl]enanthonitrile Formula: C26H33F3N2 MolecularWeight: 430.54883

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C#N)(C1=CC=C(C=C1)C(F)(F)F)C(C)C)N(CC)CC2=CC=CC=C2

Isomeric SMILES

CCC(CCC(C#N)(C1=CC=C(C=C1)C(F)(F)F)C(C)C)N(CC)CC2=CC=CC=C2

InChI

InChI=1S/C26H33F3N2/c1-5-24(31(6-2)18-21-10-8-7-9-11-21)16-17-25(19-30,20(3)4)22-12-14-23(15-13-22)26(27,28)29/h7-15,20,24H,5-6,16-18H2,1-4H3