tert-butyl 3-[[4,6-bis(bromanyl)-5-oxidanyl-1-benzofuran-3-yl]carbonylamino]butanoate

Systemtic Name: tert-butyl 3-[[4,6-bis(bromanyl)-5-oxidanyl-1-benzofuran-3-yl]carbonylamino]butanoate Openeye Name: tert-butyl 3-[(4,6-dibromo-5-hydroxy-benzofuran-3-carbonyl)amino]butanoate CAS Name: 3-[[(4,6-dibromo-5-hydroxy-3-benzofuranyl)-oxomethyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4,6-dibromo-5-hydroxy-1-benzofuran-3-carbonyl)amino]butanoate Traditional Name: 3-[(4,6-dibromo-5-hydroxy-benzofuran-3-carbonyl)amino]butyric acid tert-butyl ester Formula: C17H19Br2NO5 MolecularWeight: 477.14446

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OC(C)(C)C)NC(=O)C1=COC2=CC(=C(C(=C21)Br)O)Br

Isomeric SMILES

CC(CC(=O)OC(C)(C)C)NC(=O)C1=COC2=CC(=C(C(=C21)Br)O)Br

InChI

InChI=1S/C17H19Br2NO5/c1-8(5-12(21)25-17(2,3)4)20-16(23)9-7-24-11-6-10(18)15(22)14(19)13(9)11/h6-8,22H,5H2,1-4H3,(H,20,23)