sodium 2-[3-(phenoxymethyl)phenyl]sulfonylethanoate

Systemtic Name: sodium 2-[3-(phenoxymethyl)phenyl]sulfonylethanoate Openeye Name: sodium 2-[3-(phenoxymethyl)phenyl]sulfonylacetate CAS Name: sodium 2-[3-(phenoxymethyl)phenyl]sulfonylacetate IUPAC Name: sodium 2-[3-(phenoxymethyl)phenyl]sulfonylacetate Traditional Name: sodium 2-[3-(phenoxymethyl)phenyl]sulfonylacetate Formula: C15H13NaO5S MolecularWeight: 328.31549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC(=CC=C2)S(=O)(=O)CC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC(=CC=C2)S(=O)(=O)CC(=O)[O-].[Na+]

InChI

InChI=1S/C15H14O5S.Na/c16-15(17)11-21(18,19)14-8-4-5-12(9-14)10-20-13-6-2-1-3-7-13;/h1-9H,10-11H2,(H,16,17);/q;+1/p-1