ethyl 5-(2-azanyl-2-oxidanylidene-ethoxy)-6-bromanyl-2-(4-methoxyphenyl)-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-(2-azanyl-2-oxidanylidene-ethoxy)-6-bromanyl-2-(4-methoxyphenyl)-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-(2-amino-2-oxo-ethoxy)-6-bromo-2-(4-methoxyphenyl)benzofuran-3-carboxylate CAS Name: 5-(2-amino-2-oxoethoxy)-6-bromo-2-(4-methoxyphenyl)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-2-oxoethoxy)-6-bromo-2-(4-methoxyphenyl)-1-benzofuran-3-carboxylate Traditional Name: 5-(2-amino-2-keto-ethoxy)-6-bromo-2-(4-methoxyphenyl)benzofuran-3-carboxylic acid ethyl ester Formula: C20H18BrNO6 MolecularWeight: 448.26402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC(=O)N)Br)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC(=O)N)Br)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H18BrNO6/c1-3-26-20(24)18-13-8-16(27-10-17(22)23)14(21)9-15(13)28-19(18)11-4-6-12(25-2)7-5-11/h4-9H,3,10H2,1-2H3,(H2,22,23)