2-(3-bromanyl-5-ethanoyl-4-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-bromanyl-5-ethanoyl-4-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(3-acetyl-5-bromo-4-hydroxy-phenyl)acetic acid CAS Name: 2-(3-acetyl-5-bromo-4-hydroxyphenyl)acetic acid IUPAC Name: 2-(3-acetyl-5-bromo-4-hydroxyphenyl)acetic acid Traditional Name: 2-(3-acetyl-5-bromo-4-hydroxy-phenyl)acetic acid Formula: C10H9BrO4 MolecularWeight: 273.08006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1O)Br)CC(=O)O

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1O)Br)CC(=O)O

InChI

InChI=1S/C10H9BrO4/c1-5(12)7-2-6(4-9(13)14)3-8(11)10(7)15/h2-3,15H,4H2,1H3,(H,13,14)