2-(4-bicyclo[3.2.2]non-6-enyl)-2-(hydroxymethyl)propanedioic acid

Systemtic Name: 2-(4-bicyclo[3.2.2]non-6-enyl)-2-(hydroxymethyl)propanedioic acid Openeye Name: 2-(4-bicyclo[3.2.2]non-6-enyl)-2-(hydroxymethyl)propanedioic acid CAS Name: 2-(4-bicyclo[3.2.2]non-6-enyl)-2-(hydroxymethyl)propanedioic acid IUPAC Name: 2-(4-bicyclo[3.2.2]non-6-enyl)-2-(hydroxymethyl)propanedioic acid Traditional Name: 2-(4-bicyclo[3.2.2]non-6-enyl)-2-methylol-malonic acid Formula: C13H18O5 MolecularWeight: 254.27902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC1CCC2C(CO)(C(=O)O)C(=O)O

Isomeric SMILES

C1CC2C=CC1CCC2C(CO)(C(=O)O)C(=O)O

InChI

InChI=1S/C13H18O5/c14-7-13(11(15)16,12(17)18)10-6-3-8-1-4-9(10)5-2-8/h1,4,8-10,14H,2-3,5-7H2,(H,15,16)(H,17,18)