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

Systemtic Name: ethyl 6-bromanyl-2-tert-butyl-5-[(2-methylphenyl)methoxy]-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-2-tert-butyl-5-(o-tolylmethoxy)benzofuran-3-carboxylate CAS Name: 6-bromo-2-tert-butyl-5-[(2-methylphenyl)methoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-tert-butyl-5-[(2-methylphenyl)methoxy]-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-tert-butyl-5-(2-methylbenzyl)oxy-benzofuran-3-carboxylic acid ethyl ester Formula: C23H25BrO4 MolecularWeight: 445.3462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=CC=CC=C3C)Br)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=CC=CC=C3C)Br)C(C)(C)C

InChI

InChI=1S/C23H25BrO4/c1-6-26-22(25)20-16-11-19(27-13-15-10-8-7-9-14(15)2)17(24)12-18(16)28-21(20)23(3,4)5/h7-12H,6,13H2,1-5H3