(3-acetyloxy-5-carbonobromidoyl-phenyl) 4-oxidanylidenepentanoate

Systemtic Name: (3-acetyloxy-5-carbonobromidoyl-phenyl) 4-oxidanylidenepentanoate Openeye Name: (3-acetoxy-5-bromocarbonyl-phenyl) 4-oxopentanoate CAS Name: 4-oxopentanoic acid (3-acetyloxy-5-carbonobromidoylphenyl) ester IUPAC Name: (3-acetyloxy-5-carbonobromidoylphenyl) 4-oxopentanoate Traditional Name: 4-ketovaleric acid (3-acetoxy-5-bromocarbonyl-phenyl) ester Formula: C14H13BrO6 MolecularWeight: 357.15342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)OC1=CC(=CC(=C1)OC(=O)C)C(=O)Br

Isomeric SMILES

CC(=O)CCC(=O)OC1=CC(=CC(=C1)OC(=O)C)C(=O)Br

InChI

InChI=1S/C14H13BrO6/c1-8(16)3-4-13(18)21-12-6-10(14(15)19)5-11(7-12)20-9(2)17/h5-7H,3-4H2,1-2H3