(4-oxidanyl-2-propanoyl-phenyl) 3,5-bis(bromanyl)-4-oxidanyl-benzoate

Systemtic Name: (4-oxidanyl-2-propanoyl-phenyl) 3,5-bis(bromanyl)-4-oxidanyl-benzoate Openeye Name: (4-hydroxy-2-propanoyl-phenyl) 3,5-dibromo-4-hydroxy-benzoate CAS Name: 3,5-dibromo-4-hydroxybenzoic acid [4-hydroxy-2-(1-oxopropyl)phenyl] ester IUPAC Name: (4-hydroxy-2-propanoylphenyl) 3,5-dibromo-4-hydroxybenzoate Traditional Name: 3,5-dibromo-4-hydroxy-benzoic acid (4-hydroxy-2-propionyl-phenyl) ester Formula: C16H12Br2O5 MolecularWeight: 444.07148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=CC(=C1)O)OC(=O)C2=CC(=C(C(=C2)Br)O)Br

Isomeric SMILES

CCC(=O)C1=C(C=CC(=C1)O)OC(=O)C2=CC(=C(C(=C2)Br)O)Br

InChI

InChI=1S/C16H12Br2O5/c1-2-13(20)10-7-9(19)3-4-14(10)23-16(22)8-5-11(17)15(21)12(18)6-8/h3-7,19,21H,2H2,1H3