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

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C16H17BrN2O5 MolecularWeight: 397.22058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17BrN2O5/c1-3-6-18-16(22)19-13(20)8-23-15(21)14-9(2)11-7-10(17)4-5-12(11)24-14/h4-5,7H,3,6,8H2,1-2H3,(H2,18,19,20,22)