2-[3-(2-carboxyheptanoyloxy)phenoxy]carbonylheptanoic acid

Systemtic Name: 2-[3-(2-carboxyheptanoyloxy)phenoxy]carbonylheptanoic acid Openeye Name: 2-[3-(2-carboxyheptanoyloxy)phenoxy]carbonylheptanoic acid CAS Name: 2-[[3-(2-carboxy-1-oxoheptoxy)phenoxy]-oxomethyl]heptanoic acid IUPAC Name: 2-[3-(2-carboxyheptanoyloxy)phenoxy]carbonylheptanoic acid Traditional Name: 2-[3-(2-carboxyheptanoyloxy)phenoxy]carbonylenanthic acid Formula: C22H30O8 MolecularWeight: 422.4688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)O)C(=O)OC1=CC(=CC=C1)OC(=O)C(CCCCC)C(=O)O

Isomeric SMILES

CCCCCC(C(=O)O)C(=O)OC1=CC(=CC=C1)OC(=O)C(CCCCC)C(=O)O

InChI

InChI=1S/C22H30O8/c1-3-5-7-12-17(19(23)24)21(27)29-15-10-9-11-16(14-15)30-22(28)18(20(25)26)13-8-6-4-2/h9-11,14,17-18H,3-8,12-13H2,1-2H3,(H,23,24)(H,25,26)