5-[(4-bromanyl-2,3,6-trimethyl-phenoxy)methyl]furan-2-carboxylic acid

Systemtic Name: 5-[(4-bromanyl-2,3,6-trimethyl-phenoxy)methyl]furan-2-carboxylic acid Openeye Name: 5-[(4-bromo-2,3,6-trimethyl-phenoxy)methyl]furan-2-carboxylic acid CAS Name: 5-[(4-bromo-2,3,6-trimethylphenoxy)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-bromo-2,3,6-trimethylphenoxy)methyl]furan-2-carboxylic acid Traditional Name: 5-[(4-bromo-2,3,6-trimethyl-phenoxy)methyl]-2-furoic acid Formula: C15H15BrO4 MolecularWeight: 339.1812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OCC2=CC=C(O2)C(=O)O)C)C)Br

Isomeric SMILES

CC1=CC(=C(C(=C1OCC2=CC=C(O2)C(=O)O)C)C)Br

InChI

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