[4-[2-(3-chloranylphenoxy)ethoxy]-2-methyl-3-oxidanylidene-butan-2-yl]phosphonic acid

Systemtic Name: [4-[2-(3-chloranylphenoxy)ethoxy]-2-methyl-3-oxidanylidene-butan-2-yl]phosphonic acid Openeye Name: [3-[2-(3-chlorophenoxy)ethoxy]-1,1-dimethyl-2-oxo-propyl]phosphonic acid CAS Name: [4-[2-(3-chlorophenoxy)ethoxy]-2-methyl-3-oxobutan-2-yl]phosphonic acid IUPAC Name: [4-[2-(3-chlorophenoxy)ethoxy]-2-methyl-3-oxobutan-2-yl]phosphonic acid Traditional Name: [3-[2-(3-chlorophenoxy)ethoxy]-2-keto-1,1-dimethyl-propyl]phosphonic acid Formula: C13H18ClO6P MolecularWeight: 336.705181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)COCCOC1=CC(=CC=C1)Cl)P(=O)(O)O

Isomeric SMILES

CC(C)(C(=O)COCCOC1=CC(=CC=C1)Cl)P(=O)(O)O

InChI

InChI=1S/C13H18ClO6P/c1-13(2,21(16,17)18)12(15)9-19-6-7-20-11-5-3-4-10(14)8-11/h3-5,8H,6-7,9H2,1-2H3,(H2,16,17,18)