octadecanoate; propane-1,2-diol

Systemtic Name: octadecanoate; propane-1,2-diol Openeye Name: octadecanoate; propane-1,2-diol CAS Name: octadecanoate; propane-1,2-diol IUPAC Name: octadecanoate; propane-1,2-diol Traditional Name: propane-1,2-diol; stearate Formula: C21H43O4- MolecularWeight: 359.56372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CC(CO)O

InChI

InChI=1S/C18H36O2.C3H8O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3(5)2-4/h2-17H2,1H3,(H,19,20);3-5H,2H2,1H3/p-1