diethyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoylamino]propanedioate

Systemtic Name: diethyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoylamino]propanedioate Openeye Name: diethyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoylamino]propanedioate CAS Name: 2-[[[2-chloro-5-(trifluoromethyl)anilino]-oxomethyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoylamino]propanedioate Traditional Name: 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoylamino]malonic acid diethyl ester Formula: C15H16ClF3N2O5 MolecularWeight: 396.74615

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl

InChI

InChI=1S/C15H16ClF3N2O5/c1-3-25-12(22)11(13(23)26-4-2)21-14(24)20-10-7-8(15(17,18)19)5-6-9(10)16/h5-7,11H,3-4H2,1-2H3,(H2,20,21,24)