N'-(1-adamantyl)-N-[[4-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine

Systemtic Name: N'-(1-adamantyl)-N-[[4-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine Openeye Name: N'-(1-adamantyl)-N-[[4-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine CAS Name: N'-(1-adamantyl)-N-[[4-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine IUPAC Name: N'-(1-adamantyl)-N-[[4-(trifluoromethyl)phenyl]methyl]ethane-1,2-diamine Traditional Name: 1-adamantyl-[2-[[4-(trifluoromethyl)benzyl]amino]ethyl]amine Formula: C20H27F3N2 MolecularWeight: 352.43699

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NCCNCC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NCCNCC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H27F3N2/c21-20(22,23)18-3-1-14(2-4-18)13-24-5-6-25-19-10-15-7-16(11-19)9-17(8-15)12-19/h1-4,15-17,24-25H,5-13H2