butyl 4-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoylamino]benzoate

Systemtic Name: butyl 4-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoylamino]benzoate Openeye Name: butyl 4-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoylamino]benzoate CAS Name: 4-[[oxo-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]amino]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoylamino]benzoate Traditional Name: 4-[[2-(trifluoromethyl)-1,3-benzodioxol-2-yl]carbamoylamino]benzoic acid butyl ester Formula: C20H19F3N2O5 MolecularWeight: 424.37047

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC2(OC3=CC=CC=C3O2)C(F)(F)F

InChI

InChI=1S/C20H19F3N2O5/c1-2-3-12-28-17(26)13-8-10-14(11-9-13)24-18(27)25-20(19(21,22)23)29-15-6-4-5-7-16(15)30-20/h4-11H,2-3,12H2,1H3,(H2,24,25,27)