3-methyl-2-(2-phenylethanoylamino)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide

Systemtic Name: 3-methyl-2-(2-phenylethanoylamino)-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Openeye Name: 3-methyl-2-[(2-phenylacetyl)amino]-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide CAS Name: 3-methyl-2-[(1-oxo-2-phenylethyl)amino]-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide IUPAC Name: 3-methyl-2-[(2-phenylacetyl)amino]-N-[[3-(trifluoromethyl)phenyl]methyl]butanamide Traditional Name: 3-methyl-2-[(2-phenylacetyl)amino]-N-[3-(trifluoromethyl)benzyl]butyramide Formula: C21H23F3N2O2 MolecularWeight: 392.41473

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)NCC1=CC(=CC=C1)C(F)(F)F)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H23F3N2O2/c1-14(2)19(26-18(27)12-15-7-4-3-5-8-15)20(28)25-13-16-9-6-10-17(11-16)21(22,23)24/h3-11,14,19H,12-13H2,1-2H3,(H,25,28)(H,26,27)