ethyl 6-bromanyl-2-tert-butyl-5-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-tert-butyl-5-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-2-tert-butyl-5-[(2-chloro-6-fluoro-phenyl)methoxy]benzofuran-3-carboxylate CAS Name: 6-bromo-2-tert-butyl-5-[(2-chloro-6-fluorophenyl)methoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-tert-butyl-5-[(2-chloro-6-fluorophenyl)methoxy]-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-tert-butyl-5-(2-chloro-6-fluoro-benzyl)oxy-benzofuran-3-carboxylic acid ethyl ester Formula: C22H21BrClFO4 MolecularWeight: 483.755143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=C(C=CC=C3Cl)F)Br)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=C(C=CC=C3Cl)F)Br)C(C)(C)C

InChI

InChI=1S/C22H21BrClFO4/c1-5-27-21(26)19-12-9-18(28-11-13-15(24)7-6-8-16(13)25)14(23)10-17(12)29-20(19)22(2,3)4/h6-10H,5,11H2,1-4H3