3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-oxo-propanoic acid CAS Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-oxopropanoic acid IUPAC Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-oxopropanoic acid Traditional Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-keto-propionic acid Formula: C10H9BrO5 MolecularWeight: 289.07946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC(=O)C(=O)O)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)CC(=O)C(=O)O)Br)O

InChI

InChI=1S/C10H9BrO5/c1-16-8-4-5(2-6(11)9(8)13)3-7(12)10(14)15/h2,4,13H,3H2,1H3,(H,14,15)