(2-butoxy-2-oxidanylidene-ethyl) 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 5-bromanyl-2-oxidanyl-benzoate Openeye Name: (2-butoxy-2-oxo-ethyl) 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid (2-butoxy-2-keto-ethyl) ester Formula: C13H15BrO5 MolecularWeight: 331.1592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)C1=C(C=CC(=C1)Br)O

Isomeric SMILES

CCCCOC(=O)COC(=O)C1=C(C=CC(=C1)Br)O

InChI

InChI=1S/C13H15BrO5/c1-2-3-6-18-12(16)8-19-13(17)10-7-9(14)4-5-11(10)15/h4-5,7,15H,2-3,6,8H2,1H3