[7-(5,5-diethyloctoxy)-3-ethyl-heptan-3-yl] dihydrogen phosphate

Systemtic Name: [7-(5,5-diethyloctoxy)-3-ethyl-heptan-3-yl] dihydrogen phosphate Openeye Name: [5-(5,5-diethyloctoxy)-1,1-diethyl-pentyl] dihydrogen phosphate CAS Name: [7-(5,5-diethyloctoxy)-3-ethylheptan-3-yl] dihydrogen phosphate IUPAC Name: [7-(5,5-diethyloctoxy)-3-ethylheptan-3-yl] dihydrogen phosphate Traditional Name: [5-(5,5-diethyloctoxy)-1,1-diethyl-pentyl] dihydrogen phosphate Formula: C21H45O5P MolecularWeight: 408.552761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(CC)CCCCOCCCCC(CC)(CC)OP(=O)(O)O

Isomeric SMILES

CCCC(CC)(CC)CCCCOCCCCC(CC)(CC)OP(=O)(O)O

InChI

InChI=1S/C21H45O5P/c1-6-15-20(7-2,8-3)16-11-13-18-25-19-14-12-17-21(9-4,10-5)26-27(22,23)24/h6-19H2,1-5H3,(H2,22,23,24)