sodium 4-chloranyl-3-methanoyl-benzenesulfonate

Systemtic Name: sodium 4-chloranyl-3-methanoyl-benzenesulfonate Openeye Name: sodium 4-chloro-3-formyl-benzenesulfonate CAS Name: sodium 4-chloro-3-formylbenzenesulfonate IUPAC Name: sodium 4-chloro-3-formylbenzenesulfonate Traditional Name: sodium 4-chloro-3-formyl-besylate Formula: C7H4ClNaO4S MolecularWeight: 242.61203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5ClO4S.Na/c8-7-2-1-6(13(10,11)12)3-5(7)4-9;/h1-4H,(H,10,11,12);/q;+1/p-1