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3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid

3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid

Systemtic Name:3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid
Openeye Name:3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid
CAS Name:3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid
IUPAC Name:3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid
Traditional Name:3,4-bis(7-oxabicyclo[4.1.0]heptan-4-ylmethyl)phthalic acid
Formula: C22H26O6
MolecularWeight: 386.43824
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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(O2)CC1CC3=C(C(=C(C=C3)C(=O)O)C(=O)O)CC4CCC5C(C4)O5


Isomeric SMILES

C1CC2C(O2)CC1CC3=C(C(=C(C=C3)C(=O)O)C(=O)O)CC4CCC5C(C4)O5


InChI

InChI=1S/C22H26O6/c23-21(24)14-4-3-13(7-11-1-5-16-18(9-11)27-16)15(20(14)22(25)26)8-12-2-6-17-19(10-12)28-17/h3-4,11-12,16-19H,1-2,5-10H2,(H,23,24)(H,25,26)


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