sodium 2-chloranyl-5-(4-chlorophenyl)sulfanyl-benzenesulfonate

Systemtic Name: sodium 2-chloranyl-5-(4-chlorophenyl)sulfanyl-benzenesulfonate Openeye Name: sodium 2-chloro-5-(4-chlorophenyl)sulfanyl-benzenesulfonate CAS Name: sodium 2-chloro-5-[(4-chlorophenyl)thio]benzenesulfonate IUPAC Name: sodium 2-chloro-5-(4-chlorophenyl)sulfanylbenzenesulfonate Traditional Name: sodium 2-chloro-5-[(4-chlorophenyl)thio]besylate Formula: C12H7Cl2NaO3S2 MolecularWeight: 357.20795

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=CC(=C(C=C2)Cl)S(=O)(=O)[O-])Cl.[Na+]

Isomeric SMILES

C1=CC(=CC=C1SC2=CC(=C(C=C2)Cl)S(=O)(=O)[O-])Cl.[Na+]

InChI

InChI=1S/C12H8Cl2O3S2.Na/c13-8-1-3-9(4-2-8)18-10-5-6-11(14)12(7-10)19(15,16)17;/h1-7H,(H,15,16,17);/q;+1/p-1