sodium 4-(2-azanyl-4-chloranyl-phenoxy)-3-chloranyl-benzenesulfonate

Systemtic Name: sodium 4-(2-azanyl-4-chloranyl-phenoxy)-3-chloranyl-benzenesulfonate Openeye Name: sodium 4-(2-amino-4-chloro-phenoxy)-3-chloro-benzenesulfonate CAS Name: sodium 4-(2-amino-4-chlorophenoxy)-3-chlorobenzenesulfonate IUPAC Name: sodium 4-(2-amino-4-chlorophenoxy)-3-chlorobenzenesulfonate Traditional Name: sodium 4-(2-amino-4-chloro-phenoxy)-3-chloro-besylate Formula: C12H8Cl2NNaO4S MolecularWeight: 356.15699

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)[O-])Cl)OC2=C(C=C(C=C2)Cl)N.[Na+]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)[O-])Cl)OC2=C(C=C(C=C2)Cl)N.[Na+]

InChI

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