hexyl 4-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate

Systemtic Name: hexyl 4-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate Openeye Name: hexyl 4-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate CAS Name: 4-[[oxo-[3-(trifluoromethyl)anilino]methyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[3-(trifluoromethyl)phenyl]carbamoylamino]benzoate Traditional Name: 4-[[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=C(C=C1)NC(=O)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N2O3/c1-2-3-4-5-13-29-19(27)15-9-11-17(12-10-15)25-20(28)26-18-8-6-7-16(14-18)21(22,23)24/h6-12,14H,2-5,13H2,1H3,(H2,25,26,28)