5-[(1S)-1-(4-bromanyl-3,5-dimethyl-phenoxy)ethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(1S)-1-(4-bromanyl-3,5-dimethyl-phenoxy)ethyl]furan-2-carboxylic acid Openeye Name: 5-[(1S)-1-(4-bromo-3,5-dimethyl-phenoxy)ethyl]furan-2-carboxylic acid CAS Name: 5-[(1S)-1-(4-bromo-3,5-dimethylphenoxy)ethyl]-2-furancarboxylic acid IUPAC Name: 5-[(1S)-1-(4-bromo-3,5-dimethylphenoxy)ethyl]furan-2-carboxylic acid Traditional Name: 5-[(1S)-1-(4-bromo-3,5-dimethyl-phenoxy)ethyl]-2-furoic acid Formula: C15H15BrO4 MolecularWeight: 339.1812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)OC(C)C2=CC=C(O2)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)O[C@@H](C)C2=CC=C(O2)C(=O)O

InChI

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