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

Systemtic Name: tert-butyl 3-[[4,6-bis(bromanyl)-5-oxidanyl-1-benzofuran-3-yl]carbonylamino]-3-methyl-butanoate Openeye Name: tert-butyl 3-[(4,6-dibromo-5-hydroxy-benzofuran-3-carbonyl)amino]-3-methyl-butanoate CAS Name: 3-[[(4,6-dibromo-5-hydroxy-3-benzofuranyl)-oxomethyl]amino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4,6-dibromo-5-hydroxy-1-benzofuran-3-carbonyl)amino]-3-methylbutanoate Traditional Name: 3-[(4,6-dibromo-5-hydroxy-benzofuran-3-carbonyl)amino]-3-methyl-butyric acid tert-butyl ester Formula: C18H21Br2NO5 MolecularWeight: 491.17104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21Br2NO5/c1-17(2,3)26-12(22)7-18(4,5)21-16(24)9-8-25-11-6-10(19)15(23)14(20)13(9)11/h6,8,23H,7H2,1-5H3,(H,21,24)