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

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

Systemtic Name:2-acetyloxy-3-(5-oxidanyl-5-oxidanylidene-pentyl)benzoic acid
Openeye Name:2-acetoxy-3-(5-hydroxy-5-oxo-pentyl)benzoic acid
CAS Name:2-acetyloxy-3-(5-hydroxy-5-oxopentyl)benzoic acid
IUPAC Name:2-acetyloxy-3-(5-hydroxy-5-oxopentyl)benzoic acid
Traditional Name:2-acetoxy-3-(5-hydroxy-5-keto-pentyl)benzoic acid
Formula: C14H16O6
MolecularWeight: 280.27324
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC=C1CCCCC(=O)O)C(=O)O


Isomeric SMILES

CC(=O)OC1=C(C=CC=C1CCCCC(=O)O)C(=O)O


InChI

InChI=1S/C14H16O6/c1-9(15)20-13-10(5-2-3-8-12(16)17)6-4-7-11(13)14(18)19/h4,6-7H,2-3,5,8H2,1H3,(H,16,17)(H,18,19)


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