tert-butyl 5-(2-bromanylprop-2-enoylamino)-1-benzofuran-2-carboxylate

Systemtic Name: tert-butyl 5-(2-bromanylprop-2-enoylamino)-1-benzofuran-2-carboxylate Openeye Name: tert-butyl 5-(2-bromoprop-2-enoylamino)benzofuran-2-carboxylate CAS Name: 5-[(2-bromo-1-oxoprop-2-enyl)amino]-2-benzofurancarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(2-bromoprop-2-enoylamino)-1-benzofuran-2-carboxylate Traditional Name: 5-[(2-bromoacryloyl)amino]coumarilic acid tert-butyl ester Formula: C16H16BrNO4 MolecularWeight: 366.20654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC2=C(O1)C=CC(=C2)NC(=O)C(=C)Br

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC2=C(O1)C=CC(=C2)NC(=O)C(=C)Br

InChI

InChI=1S/C16H16BrNO4/c1-9(17)14(19)18-11-5-6-12-10(7-11)8-13(21-12)15(20)22-16(2,3)4/h5-8H,1H2,2-4H3,(H,18,19)