methyl 2-[2-(2-bromanyl-1-oxidanyl-ethyl)-1-benzofuran-7-yl]ethanoate

Systemtic Name: methyl 2-[2-(2-bromanyl-1-oxidanyl-ethyl)-1-benzofuran-7-yl]ethanoate Openeye Name: methyl 2-[2-(2-bromo-1-hydroxy-ethyl)benzofuran-7-yl]acetate CAS Name: 2-[2-(2-bromo-1-hydroxyethyl)-7-benzofuranyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-bromo-1-hydroxyethyl)-1-benzofuran-7-yl]acetate Traditional Name: 2-[2-(2-bromo-1-hydroxy-ethyl)benzofuran-7-yl]acetic acid methyl ester Formula: C13H13BrO4 MolecularWeight: 313.14392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=CC2=C1OC(=C2)C(CBr)O

Isomeric SMILES

COC(=O)CC1=CC=CC2=C1OC(=C2)C(CBr)O

InChI

InChI=1S/C13H13BrO4/c1-17-12(16)6-9-4-2-3-8-5-11(10(15)7-14)18-13(8)9/h2-5,10,15H,6-7H2,1H3