hexyl 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate

Systemtic Name: hexyl 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate Openeye Name: hexyl 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate CAS Name: 2-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate Traditional Name: 2-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoic acid hexyl ester Formula: C21H23F3N2O3 MolecularWeight: 408.41413

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=CC=C1NC(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCCCCOC(=O)C1=CC=CC=C1NC(=O)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C21H23F3N2O3/c1-2-3-4-7-13-29-19(27)17-11-5-6-12-18(17)26-20(28)25-16-10-8-9-15(14-16)21(22,23)24/h5-6,8-12,14H,2-4,7,13H2,1H3,(H2,25,26,28)