5-[(4-bromanyl-2,6-dimethyl-phenoxy)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-bromanyl-2,6-dimethyl-phenoxy)methyl]furan-2-carboxylate Openeye Name: 5-[(4-bromo-2,6-dimethyl-phenoxy)methyl]furan-2-carboxylate CAS Name: 5-[(4-bromo-2,6-dimethylphenoxy)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-bromo-2,6-dimethylphenoxy)methyl]furan-2-carboxylate Traditional Name: 5-[(4-bromo-2,6-dimethyl-phenoxy)methyl]-2-furoate Formula: C14H12BrO4- MolecularWeight: 324.14668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=C(O2)C(=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=C(O2)C(=O)[O-])C)Br

InChI

InChI=1S/C14H13BrO4/c1-8-5-10(15)6-9(2)13(8)18-7-11-3-4-12(19-11)14(16)17/h3-6H,7H2,1-2H3,(H,16,17)/p-1