[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C16H18BrNO4 MolecularWeight: 368.22242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)C

InChI

InChI=1S/C16H18BrNO4/c1-4-9(2)18-14(19)8-21-16(20)15-10(3)12-7-11(17)5-6-13(12)22-15/h5-7,9H,4,8H2,1-3H3,(H,18,19)