3,5-bis(2-acetyloxyethanoylamino)-2,4,6-tris(bromanyl)benzoic acid

Systemtic Name: 3,5-bis(2-acetyloxyethanoylamino)-2,4,6-tris(bromanyl)benzoic acid Openeye Name: 3,5-bis[(2-acetoxyacetyl)amino]-2,4,6-tribromo-benzoic acid CAS Name: 3,5-bis[(2-acetyloxy-1-oxoethyl)amino]-2,4,6-tribromobenzoic acid IUPAC Name: 3,5-bis[(2-acetyloxyacetyl)amino]-2,4,6-tribromobenzoic acid Traditional Name: 3,5-bis[(2-acetoxyacetyl)amino]-2,4,6-tribromo-benzoic acid Formula: C15H13Br3N2O8 MolecularWeight: 588.98432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)NC1=C(C(=C(C(=C1Br)C(=O)O)Br)NC(=O)COC(=O)C)Br

Isomeric SMILES

CC(=O)OCC(=O)NC1=C(C(=C(C(=C1Br)C(=O)O)Br)NC(=O)COC(=O)C)Br

InChI

InChI=1S/C15H13Br3N2O8/c1-5(21)27-3-7(23)19-13-10(16)9(15(25)26)11(17)14(12(13)18)20-8(24)4-28-6(2)22/h3-4H2,1-2H3,(H,19,23)(H,20,24)(H,25,26)