3-(3-oxidanylpropoxycarbonyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid

Systemtic Name: 3-(3-oxidanylpropoxycarbonyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid Openeye Name: 3-(3-hydroxypropoxycarbonyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid CAS Name: 3-[3-hydroxypropoxy(oxo)methyl]-2-bicyclo[2.2.2]oct-5-enecarboxylic acid IUPAC Name: 3-(3-hydroxypropoxycarbonyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid Traditional Name: 3-(3-hydroxypropoxycarbonyl)bicyclo[2.2.2]oct-5-ene-2-carboxylic acid Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC1C(C2C(=O)OCCCO)C(=O)O

Isomeric SMILES

C1CC2C=CC1C(C2C(=O)OCCCO)C(=O)O

InChI

InChI=1S/C13H18O5/c14-6-1-7-18-13(17)11-9-4-2-8(3-5-9)10(11)12(15)16/h2,4,8-11,14H,1,3,5-7H2,(H,15,16)