methyl 3-[[4-(trifluoromethyl)cyclohexyl]carbamoylamino]benzoate

Systemtic Name: methyl 3-[[4-(trifluoromethyl)cyclohexyl]carbamoylamino]benzoate Openeye Name: methyl 3-[[4-(trifluoromethyl)cyclohexyl]carbamoylamino]benzoate CAS Name: 3-[[oxo-[[4-(trifluoromethyl)cyclohexyl]amino]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(trifluoromethyl)cyclohexyl]carbamoylamino]benzoate Traditional Name: 3-[[4-(trifluoromethyl)cyclohexyl]carbamoylamino]benzoic acid methyl ester Formula: C16H19F3N2O3 MolecularWeight: 344.32887

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)NC2CCC(CC2)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)NC2CCC(CC2)C(F)(F)F

InChI

InChI=1S/C16H19F3N2O3/c1-24-14(22)10-3-2-4-13(9-10)21-15(23)20-12-7-5-11(6-8-12)16(17,18)19/h2-4,9,11-12H,5-8H2,1H3,(H2,20,21,23)