4-(8-chloranyloctyl)benzenesulfonic acid; sodium

Systemtic Name: 4-(8-chloranyloctyl)benzenesulfonic acid; sodium Openeye Name: 4-(8-chlorooctyl)benzenesulfonic acid; sodium CAS Name: 4-(8-chlorooctyl)benzenesulfonic acid; sodium IUPAC Name: 4-(8-chlorooctyl)benzenesulfonic acid; sodium Traditional Name: 4-(8-chlorooctyl)besylic acid; sodium Formula: C14H21ClNaO3S MolecularWeight: 327.82251

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCCCCCl)S(=O)(=O)O.[Na]

Isomeric SMILES

C1=CC(=CC=C1CCCCCCCCCl)S(=O)(=O)O.[Na]

InChI

InChI=1S/C14H21ClO3S.Na/c15-12-6-4-2-1-3-5-7-13-8-10-14(11-9-13)19(16,17)18;/h8-11H,1-7,12H2,(H,16,17,18);