2,3,5-tris(chloranyl)-6-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: 2,3,5-tris(chloranyl)-6-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]benzoate Openeye Name: 2,3,5-trichloro-6-[2-(isobutylamino)-2-oxo-ethoxy]benzoate CAS Name: 2,3,5-trichloro-6-[2-(2-methylpropylamino)-2-oxoethoxy]benzoate IUPAC Name: 2,3,5-trichloro-6-[2-(2-methylpropylamino)-2-oxoethoxy]benzoate Traditional Name: 2,3,5-trichloro-6-[2-(isobutylamino)-2-keto-ethoxy]benzoate Formula: C13H13Cl3NO4- MolecularWeight: 353.60562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC1=C(C(=C(C=C1Cl)Cl)Cl)C(=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)COC1=C(C(=C(C=C1Cl)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C13H14Cl3NO4/c1-6(2)4-17-9(18)5-21-12-8(15)3-7(14)11(16)10(12)13(19)20/h3,6H,4-5H2,1-2H3,(H,17,18)(H,19,20)/p-1