calcium 3-chloranylbenzenesulfonate

Systemtic Name: calcium 3-chloranylbenzenesulfonate Openeye Name: calcium 3-chlorobenzenesulfonate CAS Name: calcium 3-chlorobenzenesulfonate IUPAC Name: calcium 3-chlorobenzenesulfonate Traditional Name: calcium 3-chlorobesylate Formula: C6H4CaClO3S+ MolecularWeight: 231.69016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)S(=O)(=O)[O-].[Ca+2]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)S(=O)(=O)[O-].[Ca+2]

InChI

InChI=1S/C6H5ClO3S.Ca/c7-5-2-1-3-6(4-5)11(8,9)10;/h1-4H,(H,8,9,10);/q;+2/p-1