sodium 5-(4-phenoxyphenyl)thiophene-2-sulfonate

Systemtic Name: sodium 5-(4-phenoxyphenyl)thiophene-2-sulfonate Openeye Name: sodium 5-(4-phenoxyphenyl)thiophene-2-sulfonate CAS Name: sodium 5-(4-phenoxyphenyl)-2-thiophenesulfonate IUPAC Name: sodium 5-(4-phenoxyphenyl)thiophene-2-sulfonate Traditional Name: sodium 5-(4-phenoxyphenyl)thiophene-2-sulfonate Formula: C16H11NaO4S2 MolecularWeight: 354.37591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC=C(S3)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC=C(S3)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C16H12O4S2.Na/c17-22(18,19)16-11-10-15(21-16)12-6-8-14(9-7-12)20-13-4-2-1-3-5-13;/h1-11H,(H,17,18,19);/q;+1/p-1