4-oxidanylidene-4-[[2,4,5-tris(chloranyl)phenyl]carbamoylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[2,4,5-tris(chloranyl)phenyl]carbamoylamino]butanoic acid Openeye Name: 4-oxo-4-[(2,4,5-trichlorophenyl)carbamoylamino]butanoic acid CAS Name: 4-oxo-4-[[oxo-(2,4,5-trichloroanilino)methyl]amino]butanoic acid IUPAC Name: 4-oxo-4-[(2,4,5-trichlorophenyl)carbamoylamino]butanoic acid Traditional Name: 4-keto-4-[(2,4,5-trichlorophenyl)carbamoylamino]butyric acid Formula: C11H9Cl3N2O4 MolecularWeight: 339.55916

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Cl)Cl)Cl)NC(=O)NC(=O)CCC(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1Cl)Cl)Cl)NC(=O)NC(=O)CCC(=O)O

InChI

InChI=1S/C11H9Cl3N2O4/c12-5-3-7(14)8(4-6(5)13)15-11(20)16-9(17)1-2-10(18)19/h3-4H,1-2H2,(H,18,19)(H2,15,16,17,20)