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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)OCC2=C(OC(=C2)C(=O)O)C

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)OCC2=C(OC(=C2)C(=O)O)C

InChI

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