6-oxidanylidene-6-[[2,4,5-tris(chloranyl)phenyl]amino]hexanoic acid

Systemtic Name: 6-oxidanylidene-6-[[2,4,5-tris(chloranyl)phenyl]amino]hexanoic acid Openeye Name: 6-oxo-6-(2,4,5-trichloroanilino)hexanoic acid CAS Name: 6-oxo-6-(2,4,5-trichloroanilino)hexanoic acid IUPAC Name: 6-oxo-6-(2,4,5-trichloroanilino)hexanoic acid Traditional Name: 6-keto-6-(2,4,5-trichloroanilino)hexanoic acid Formula: C12H12Cl3NO3 MolecularWeight: 324.58758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12Cl3NO3/c13-7-5-9(15)10(6-8(7)14)16-11(17)3-1-2-4-12(18)19/h5-6H,1-4H2,(H,16,17)(H,18,19)