disodium [2-[2,6-di(propan-2-yl)phenoxy]-2-oxidanylidene-ethyl] phosphate

Systemtic Name: disodium [2-[2,6-di(propan-2-yl)phenoxy]-2-oxidanylidene-ethyl] phosphate Openeye Name: disodium [2-(2,6-diisopropylphenoxy)-2-oxo-ethyl] phosphate CAS Name: disodium [2-[2,6-di(propan-2-yl)phenoxy]-2-oxoethyl] phosphate IUPAC Name: disodium [2-[2,6-di(propan-2-yl)phenoxy]-2-oxoethyl] phosphate Traditional Name: disodium [2-(2,6-diisopropylphenoxy)-2-keto-ethyl] phosphate Formula: C14H19Na2O6P MolecularWeight: 360.250361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)COP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)COP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C14H21O6P.2Na/c1-9(2)11-6-5-7-12(10(3)4)14(11)20-13(15)8-19-21(16,17)18;;/h5-7,9-10H,8H2,1-4H3,(H2,16,17,18);;/q;2*+1/p-2