3-chloranyl-5-[2-(3-chloranyl-4-oxidanyl-phenyl)propan-2-yl]-2-oxidanyl-benzenesulfonic acid; sodium

Systemtic Name: 3-chloranyl-5-[2-(3-chloranyl-4-oxidanyl-phenyl)propan-2-yl]-2-oxidanyl-benzenesulfonic acid; sodium Openeye Name: 3-chloro-5-[1-(3-chloro-4-hydroxy-phenyl)-1-methyl-ethyl]-2-hydroxy-benzenesulfonic acid; sodium CAS Name: 3-chloro-5-[2-(3-chloro-4-hydroxyphenyl)propan-2-yl]-2-hydroxybenzenesulfonic acid; sodium IUPAC Name: 3-chloro-5-[2-(3-chloro-4-hydroxyphenyl)propan-2-yl]-2-hydroxybenzenesulfonic acid; sodium Traditional Name: 3-chloro-5-[1-(3-chloro-4-hydroxy-phenyl)-1-methyl-ethyl]-2-hydroxy-besylic acid; sodium Formula: C15H14Cl2NaO5S MolecularWeight: 400.22943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14Cl2O5S.Na/c1-15(2,8-3-4-12(18)10(16)5-8)9-6-11(17)14(19)13(7-9)23(20,21)22;/h3-7,18-19H,1-2H3,(H,20,21,22);