4-(5-chloranylpentyl)benzenesulfonic acid; sodium

Systemtic Name: 4-(5-chloranylpentyl)benzenesulfonic acid; sodium Openeye Name: 4-(5-chloropentyl)benzenesulfonic acid; sodium CAS Name: 4-(5-chloropentyl)benzenesulfonic acid; sodium IUPAC Name: 4-(5-chloropentyl)benzenesulfonic acid; sodium Traditional Name: 4-(5-chloropentyl)besylic acid; sodium Formula: C11H15ClNaO3S MolecularWeight: 285.74277

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCCl)S(=O)(=O)O.[Na]

Isomeric SMILES

C1=CC(=CC=C1CCCCCCl)S(=O)(=O)O.[Na]

InChI

InChI=1S/C11H15ClO3S.Na/c12-9-3-1-2-4-10-5-7-11(8-6-10)16(13,14)15;/h5-8H,1-4,9H2,(H,13,14,15);