2-chloranyl-6-(2-cyanophenyl)carbonyloxy-benzenesulfonic acid

Systemtic Name: 2-chloranyl-6-(2-cyanophenyl)carbonyloxy-benzenesulfonic acid Openeye Name: 2-chloro-6-(2-cyanobenzoyl)oxy-benzenesulfonic acid CAS Name: 2-chloro-6-[(2-cyanophenyl)-oxomethoxy]benzenesulfonic acid IUPAC Name: 2-chloro-6-(2-cyanobenzoyl)oxybenzenesulfonic acid Traditional Name: 2-chloro-6-(2-cyanobenzoyl)oxy-besylic acid Formula: C14H8ClNO5S MolecularWeight: 337.73502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C(=O)OC2=C(C(=CC=C2)Cl)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C(=O)OC2=C(C(=CC=C2)Cl)S(=O)(=O)O

InChI

InChI=1S/C14H8ClNO5S/c15-11-6-3-7-12(13(11)22(18,19)20)21-14(17)10-5-2-1-4-9(10)8-16/h1-7H,(H,18,19,20)