3-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]butanoic acid Openeye Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]butanoic acid CAS Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]butanoic acid IUPAC Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]butanoic acid Traditional Name: 3-methyl-2-[[3-(trifluoromethyl)benzyl]amino]butyric acid Formula: C13H16F3NO2 MolecularWeight: 275.26685

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C13H16F3NO2/c1-8(2)11(12(18)19)17-7-9-4-3-5-10(6-9)13(14,15)16/h3-6,8,11,17H,7H2,1-2H3,(H,18,19)