5-[(4-bromanyl-2,3,5-trimethyl-phenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-bromanyl-2,3,5-trimethyl-phenoxy)methyl]furan-2-carboxylate Openeye Name: 5-[(4-bromo-2,3,5-trimethyl-phenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(4-bromo-2,3,5-trimethylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-bromo-2,3,5-trimethylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(4-bromo-2,3,5-trimethyl-phenoxy)methyl]-2-furoate Formula: C15H14BrO4- MolecularWeight: 338.17326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCC2=CC=C(O2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCC2=CC=C(O2)C(=O)[O-]

InChI

InChI=1S/C15H15BrO4/c1-8-6-13(9(2)10(3)14(8)16)19-7-11-4-5-12(20-11)15(17)18/h4-6H,7H2,1-3H3,(H,17,18)/p-1