2-(1-adamantylamino)-3,3-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]butanamide

Systemtic Name: 2-(1-adamantylamino)-3,3-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]butanamide Openeye Name: 2-(1-adamantylamino)-3,3-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]butanamide CAS Name: 2-(1-adamantylamino)-3,3-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]butanamide IUPAC Name: 2-(1-adamantylamino)-3,3-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]butanamide Traditional Name: 2-(1-adamantylamino)-3,3-dimethyl-N-[4-(trifluoromethyl)benzyl]butyramide Formula: C24H33F3N2O MolecularWeight: 422.52683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NCC1=CC=C(C=C1)C(F)(F)F)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)(C)C(C(=O)NCC1=CC=C(C=C1)C(F)(F)F)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H33F3N2O/c1-22(2,3)20(29-23-11-16-8-17(12-23)10-18(9-16)13-23)21(30)28-14-15-4-6-19(7-5-15)24(25,26)27/h4-7,16-18,20,29H,8-14H2,1-3H3,(H,28,30)