methyl 1-[[2-(trifluoromethyl)phenyl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[2-(trifluoromethyl)phenyl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(trifluoromethyl)benzoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(trifluoromethyl)benzoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(trifluoromethyl)benzoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C16H18F3NO3 MolecularWeight: 329.31423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C16H18F3NO3/c1-23-14(22)15(9-5-2-6-10-15)20-13(21)11-7-3-4-8-12(11)16(17,18)19/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,20,21)