2-[3-ethyl-1-(2-ethylhexoxy)heptyl]-2-(hydroxymethyl)propane-1,3-diol

Systemtic Name: 2-[3-ethyl-1-(2-ethylhexoxy)heptyl]-2-(hydroxymethyl)propane-1,3-diol Openeye Name: 2-[3-ethyl-1-(2-ethylhexoxy)heptyl]-2-(hydroxymethyl)propane-1,3-diol CAS Name: 2-[3-ethyl-1-(2-ethylhexoxy)heptyl]-2-(hydroxymethyl)propane-1,3-diol IUPAC Name: 2-[3-ethyl-1-(2-ethylhexoxy)heptyl]-2-(hydroxymethyl)propane-1,3-diol Traditional Name: 2-[3-ethyl-1-(2-ethylhexoxy)heptyl]-2-methylol-propane-1,3-diol Formula: C21H44O4 MolecularWeight: 360.57166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(C(CO)(CO)CO)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)CC(C(CO)(CO)CO)OCC(CC)CCCC

InChI

InChI=1S/C21H44O4/c1-5-9-11-18(7-3)13-20(21(15-22,16-23)17-24)25-14-19(8-4)12-10-6-2/h18-20,22-24H,5-17H2,1-4H3