5-[(1S)-1-(4-bromanyl-2,6-dimethyl-phenoxy)ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1S)-1-(4-bromanyl-2,6-dimethyl-phenoxy)ethyl]furan-2-carboxylate Openeye Name: 5-[(1S)-1-(4-bromo-2,6-dimethyl-phenoxy)ethyl]furan-2-carboxylate CAS Name: 5-[(1S)-1-(4-bromo-2,6-dimethylphenoxy)ethyl]-2-furancarboxylate IUPAC Name: 5-[(1S)-1-(4-bromo-2,6-dimethylphenoxy)ethyl]furan-2-carboxylate Traditional Name: 5-[(1S)-1-(4-bromo-2,6-dimethyl-phenoxy)ethyl]-2-furoate Formula: C15H14BrO4- MolecularWeight: 338.17326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C2=CC=C(O2)C(=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1O[C@@H](C)C2=CC=C(O2)C(=O)[O-])C)Br

InChI

InChI=1S/C15H15BrO4/c1-8-6-11(16)7-9(2)14(8)19-10(3)12-4-5-13(20-12)15(17)18/h4-7,10H,1-3H3,(H,17,18)/p-1/t10-/m0/s1