methyl 2-[(2R)-5-bromanyl-2-ethyl-3-oxidanylidene-1-benzofuran-2-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-5-bromanyl-2-ethyl-3-oxidanylidene-1-benzofuran-2-yl]ethanoate Openeye Name: methyl 2-[(2R)-5-bromo-2-ethyl-3-oxo-benzofuran-2-yl]acetate CAS Name: 2-[(2R)-5-bromo-2-ethyl-3-oxo-2-benzofuranyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-5-bromo-2-ethyl-3-oxo-1-benzofuran-2-yl]acetate Traditional Name: 2-[(2R)-5-bromo-2-ethyl-3-keto-coumaran-2-yl]acetic acid methyl ester Formula: C13H13BrO4 MolecularWeight: 313.14392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C2=C(O1)C=CC(=C2)Br)CC(=O)OC

Isomeric SMILES

CC[C@]1(C(=O)C2=C(O1)C=CC(=C2)Br)CC(=O)OC

InChI

InChI=1S/C13H13BrO4/c1-3-13(7-11(15)17-2)12(16)9-6-8(14)4-5-10(9)18-13/h4-6H,3,7H2,1-2H3/t13-/m1/s1