2-[2,6-bis(trifluoromethyl)phenyl]-5-[(phenylmethyl)-propyl-amino]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-[2,6-bis(trifluoromethyl)phenyl]-5-[(phenylmethyl)-propyl-amino]-2-propan-2-yl-pentanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-[2,6-bis(trifluoromethyl)phenyl]-2-isopropyl-pentanenitrile CAS Name: 2-[2,6-bis(trifluoromethyl)phenyl]-5-[(phenylmethyl)-propylamino]-2-propan-2-ylpentanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-[2,6-bis(trifluoromethyl)phenyl]-2-propan-2-ylpentanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-[2,6-bis(trifluoromethyl)phenyl]-2-isopropyl-valeronitrile Formula: C26H30F6N2 MolecularWeight: 484.520219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1=C(C=CC=C1C(F)(F)F)C(F)(F)F)C(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCCN(CCCC(C#N)(C1=C(C=CC=C1C(F)(F)F)C(F)(F)F)C(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C26H30F6N2/c1-4-15-34(17-20-10-6-5-7-11-20)16-9-14-24(18-33,19(2)3)23-21(25(27,28)29)12-8-13-22(23)26(30,31)32/h5-8,10-13,19H,4,9,14-17H2,1-3H3