[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 5-bromanyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 5-bromo-3-methyl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-2-benzofurancarboxylic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 5-bromo-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-methyl-coumarilic acid (2-keto-2-mesidino-ethyl) ester Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2=C(C3=C(O2)C=CC(=C3)Br)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)COC(=O)C2=C(C3=C(O2)C=CC(=C3)Br)C)C

InChI

InChI=1S/C21H20BrNO4/c1-11-7-12(2)19(13(3)8-11)23-18(24)10-26-21(25)20-14(4)16-9-15(22)5-6-17(16)27-20/h5-9H,10H2,1-4H3,(H,23,24)