9-(5,5-dimethyl-8-phosphonooxy-octoxy)-5,5-dimethyl-nonanoic acid

Systemtic Name: 9-(5,5-dimethyl-8-phosphonooxy-octoxy)-5,5-dimethyl-nonanoic acid Openeye Name: 9-(5,5-dimethyl-8-phosphonooxy-octoxy)-5,5-dimethyl-nonanoic acid CAS Name: 9-(5,5-dimethyl-8-phosphonooxyoctoxy)-5,5-dimethylnonanoic acid IUPAC Name: 9-(5,5-dimethyl-8-phosphonooxyoctoxy)-5,5-dimethylnonanoic acid Traditional Name: 9-(5,5-dimethyl-8-phosphonooxy-octoxy)-5,5-dimethyl-pelargonic acid Formula: C21H43O7P MolecularWeight: 438.535681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOCCCCC(C)(C)CCCOP(=O)(O)O)CCCC(=O)O

Isomeric SMILES

CC(C)(CCCCOCCCCC(C)(C)CCCOP(=O)(O)O)CCCC(=O)O

InChI

InChI=1S/C21H43O7P/c1-20(2,14-9-11-19(22)23)12-5-7-16-27-17-8-6-13-21(3,4)15-10-18-28-29(24,25)26/h5-18H2,1-4H3,(H,22,23)(H2,24,25,26)