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2-acetyloxy-3-(5-oxidanyl-5-oxidanylidene-pentanoyl)benzoic acid

2-acetyloxy-3-(5-oxidanyl-5-oxidanylidene-pentanoyl)benzoic acid

Systemtic Name:2-acetyloxy-3-(5-oxidanyl-5-oxidanylidene-pentanoyl)benzoic acid
Openeye Name:2-acetoxy-3-(5-hydroxy-5-oxo-pentanoyl)benzoic acid
CAS Name:2-acetyloxy-3-(5-hydroxy-1,5-dioxopentyl)benzoic acid
IUPAC Name:2-acetyloxy-3-(5-hydroxy-5-oxopentanoyl)benzoic acid
Traditional Name:2-acetoxy-3-(5-hydroxy-5-keto-pentanoyl)benzoic acid
Formula: C14H14O7
MolecularWeight: 294.25676
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC=C1C(=O)O)C(=O)CCCC(=O)O


Isomeric SMILES

CC(=O)OC1=C(C=CC=C1C(=O)O)C(=O)CCCC(=O)O


InChI

InChI=1S/C14H14O7/c1-8(15)21-13-9(4-2-5-10(13)14(19)20)11(16)6-3-7-12(17)18/h2,4-5H,3,6-7H2,1H3,(H,17,18)(H,19,20)


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