[1-[[3,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [1-[[3,5-bis(chloranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-(3,5-dichloroanilino)-1-methyl-2-oxo-ethyl] 5-ethoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-ethoxy-3-methyl-2-benzofurancarboxylic acid [1-(3,5-dichloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,5-dichloroanilino)-1-oxopropan-2-yl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-ethoxy-3-methyl-coumarilic acid [2-(3,5-dichloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H19Cl2NO5 MolecularWeight: 436.28526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)OC(C)C(=O)NC3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)OC(C)C(=O)NC3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C21H19Cl2NO5/c1-4-27-16-5-6-18-17(10-16)11(2)19(29-18)21(26)28-12(3)20(25)24-15-8-13(22)7-14(23)9-15/h5-10,12H,4H2,1-3H3,(H,24,25)