2-(1-iodanylheptyl)undecanoate; propane-1,2,3-triol

Systemtic Name: 2-(1-iodanylheptyl)undecanoate; propane-1,2,3-triol Openeye Name: glycerol; 2-(1-iodoheptyl)undecanoate CAS Name: 2-(1-iodoheptyl)undecanoate; propane-1,2,3-triol IUPAC Name: 2-(1-iodoheptyl)undecanoate; propane-1,2,3-triol Traditional Name: glycerol; 2-(1-iodoheptyl)undecanoate Formula: C21H42IO5- MolecularWeight: 501.45965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(CCCCCC)I)C(=O)[O-].C(C(CO)O)O

Isomeric SMILES

CCCCCCCCCC(C(CCCCCC)I)C(=O)[O-].C(C(CO)O)O

InChI

InChI=1S/C18H35IO2.C3H8O3/c1-3-5-7-9-10-11-12-14-16(18(20)21)17(19)15-13-8-6-4-2;4-1-3(6)2-5/h16-17H,3-15H2,1-2H3,(H,20,21);3-6H,1-2H2/p-1