sodium 2-(4-azanylphenoxy)-3,5-bis(chloranyl)benzenesulfonate

Systemtic Name: sodium 2-(4-azanylphenoxy)-3,5-bis(chloranyl)benzenesulfonate Openeye Name: sodium 2-(4-aminophenoxy)-3,5-dichloro-benzenesulfonate CAS Name: sodium 2-(4-aminophenoxy)-3,5-dichlorobenzenesulfonate IUPAC Name: sodium 2-(4-aminophenoxy)-3,5-dichlorobenzenesulfonate Traditional Name: sodium 2-(4-aminophenoxy)-3,5-dichloro-besylate Formula: C12H8Cl2NNaO4S MolecularWeight: 356.15699

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)OC2=C(C=C(C=C2S(=O)(=O)[O-])Cl)Cl.[Na+]

Isomeric SMILES

C1=CC(=CC=C1N)OC2=C(C=C(C=C2S(=O)(=O)[O-])Cl)Cl.[Na+]

InChI

InChI=1S/C12H9Cl2NO4S.Na/c13-7-5-10(14)12(11(6-7)20(16,17)18)19-9-3-1-8(15)2-4-9;/h1-6H,15H2,(H,16,17,18);/q;+1/p-1