2-[[3-(trifluoromethyl)phenyl]methylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]cyclohexane-1-carboxylic acid Openeye Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]cyclohexanecarboxylic acid CAS Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[3-(trifluoromethyl)phenyl]methylamino]cyclohexane-1-carboxylic acid Traditional Name: 2-[[3-(trifluoromethyl)benzyl]amino]cyclohexanecarboxylic acid Formula: C15H18F3NO2 MolecularWeight: 301.30413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)O)NCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1CCC(C(C1)C(=O)O)NCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H18F3NO2/c16-15(17,18)11-5-3-4-10(8-11)9-19-13-7-2-1-6-12(13)14(20)21/h3-5,8,12-13,19H,1-2,6-7,9H2,(H,20,21)