7-(3-phenylmethoxy-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid

Systemtic Name: 7-(3-phenylmethoxy-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid Openeye Name: 7-(3-benzyloxy-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid CAS Name: 7-(3-phenylmethoxy-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid IUPAC Name: 7-(3-phenylmethoxy-7-oxabicyclo[2.2.1]heptan-2-yl)heptanoic acid Traditional Name: 7-(3-benzoxy-7-oxabicyclo[2.2.1]heptan-2-yl)enanthic acid Formula: C20H28O4 MolecularWeight: 332.43392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C(C1O2)CCCCCCC(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC2C(C(C1O2)CCCCCCC(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H28O4/c21-19(22)11-7-2-1-6-10-16-17-12-13-18(24-17)20(16)23-14-15-8-4-3-5-9-15/h3-5,8-9,16-18,20H,1-2,6-7,10-14H2,(H,21,22)