6-(2-bromanyl-4,5-dimethoxy-phenyl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(2-bromanyl-4,5-dimethoxy-phenyl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(2-bromo-4,5-dimethoxy-phenyl)-6-oxo-hexanoic acid CAS Name: 6-(2-bromo-4,5-dimethoxyphenyl)-6-oxohexanoic acid IUPAC Name: 6-(2-bromo-4,5-dimethoxyphenyl)-6-oxohexanoic acid Traditional Name: 6-(2-bromo-4,5-dimethoxy-phenyl)-6-keto-hexanoic acid Formula: C14H17BrO5 MolecularWeight: 345.18578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)CCCCC(=O)O)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)CCCCC(=O)O)Br)OC

InChI

InChI=1S/C14H17BrO5/c1-19-12-7-9(10(15)8-13(12)20-2)11(16)5-3-4-6-14(17)18/h7-8H,3-6H2,1-2H3,(H,17,18)