methyl 1-[[4-(trifluoromethylsulfanyl)phenyl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[4-(trifluoromethylsulfanyl)phenyl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[4-(trifluoromethylsulfanyl)benzoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[oxo-[4-(trifluoromethylthio)phenyl]methyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-(trifluoromethylsulfanyl)benzoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[4-(trifluoromethylthio)benzoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C16H18F3NO3S MolecularWeight: 361.37923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C16H18F3NO3S/c1-23-14(22)15(9-3-2-4-10-15)20-13(21)11-5-7-12(8-6-11)24-16(17,18)19/h5-8H,2-4,9-10H2,1H3,(H,20,21)