2-[(E)-7-oxidanyl-7-oxidanylidene-hept-5-enyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid

Systemtic Name: 2-[(E)-7-oxidanyl-7-oxidanylidene-hept-5-enyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid Openeye Name: 2-[(E)-7-hydroxy-7-oxo-hept-5-enyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid CAS Name: 2-[(E)-7-hydroxy-7-oxohept-5-enyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid IUPAC Name: 2-[(E)-7-hydroxy-7-oxohept-5-enyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid Traditional Name: 2-[(E)-7-hydroxy-7-keto-hept-5-enyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid Formula: C14H20O5 MolecularWeight: 268.3056

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C(C1O2)CCCCC=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC2C(C(C1O2)CCCC/C=C/C(=O)O)C(=O)O

InChI

InChI=1S/C14H20O5/c15-12(16)6-4-2-1-3-5-9-10-7-8-11(19-10)13(9)14(17)18/h4,6,9-11,13H,1-3,5,7-8H2,(H,15,16)(H,17,18)/b6-4+