ethyl 6-bromanyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-[(4-methoxycarbonylphenyl)methoxy]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-5-(4-carbomethoxybenzyl)oxy-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C21H19BrO6 MolecularWeight: 447.27596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=CC=C(C=C3)C(=O)OC)Br)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OCC3=CC=C(C=C3)C(=O)OC)Br)C

InChI

InChI=1S/C21H19BrO6/c1-4-26-21(24)19-12(2)28-17-10-16(22)18(9-15(17)19)27-11-13-5-7-14(8-6-13)20(23)25-3/h5-10H,4,11H2,1-3H3