2-chloranyl-5-(3-sulfophenyl)sulfonyl-benzenesulfonic acid

Systemtic Name: 2-chloranyl-5-(3-sulfophenyl)sulfonyl-benzenesulfonic acid Openeye Name: 2-chloro-5-(3-sulfophenyl)sulfonyl-benzenesulfonic acid CAS Name: 2-chloro-5-(3-sulfophenyl)sulfonylbenzenesulfonic acid IUPAC Name: 2-chloro-5-(3-sulfophenyl)sulfonylbenzenesulfonic acid Traditional Name: 2-chloro-5-(3-sulfophenyl)sulfonyl-besylic acid Formula: C12H9ClO8S3 MolecularWeight: 412.84306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)O

InChI

InChI=1S/C12H9ClO8S3/c13-11-5-4-9(7-12(11)24(19,20)21)22(14,15)8-2-1-3-10(6-8)23(16,17)18/h1-7H,(H,16,17,18)(H,19,20,21)