2,2-bis[(4-methyl-7-oxabicyclo[4.1.0]heptan-5-yl)methyl]hexanedioic acid

Systemtic Name: 2,2-bis[(4-methyl-7-oxabicyclo[4.1.0]heptan-5-yl)methyl]hexanedioic acid Openeye Name: 2,2-bis[(4-methyl-7-oxabicyclo[4.1.0]heptan-5-yl)methyl]hexanedioic acid CAS Name: 2,2-bis[(4-methyl-7-oxabicyclo[4.1.0]heptan-5-yl)methyl]hexanedioic acid IUPAC Name: 2,2-bis[(4-methyl-7-oxabicyclo[4.1.0]heptan-5-yl)methyl]hexanedioic acid Traditional Name: 2,2-bis[(4-methyl-7-oxabicyclo[4.1.0]heptan-5-yl)methyl]adipic acid Formula: C22H34O6 MolecularWeight: 394.50176

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(C1CC(CCCC(=O)O)(CC3C(CCC4C3O4)C)C(=O)O)O2

Isomeric SMILES

CC1CCC2C(C1CC(CCCC(=O)O)(CC3C(CCC4C3O4)C)C(=O)O)O2

InChI

InChI=1S/C22H34O6/c1-12-5-7-16-19(27-16)14(12)10-22(21(25)26,9-3-4-18(23)24)11-15-13(2)6-8-17-20(15)28-17/h12-17,19-20H,3-11H2,1-2H3,(H,23,24)(H,25,26)