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

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C17H20BrNO4 MolecularWeight: 382.249

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20BrNO4/c1-4-12(5-2)19-15(20)9-22-17(21)16-10(3)13-8-11(18)6-7-14(13)23-16/h6-8,12H,4-5,9H2,1-3H3,(H,19,20)