sodium 2-(phenylmethyl)benzenesulfonate

Systemtic Name: sodium 2-(phenylmethyl)benzenesulfonate Openeye Name: sodium 2-benzylbenzenesulfonate CAS Name: sodium 2-(phenylmethyl)benzenesulfonate IUPAC Name: sodium 2-benzylbenzenesulfonate Traditional Name: sodium 2-benzylbesylate Formula: C13H11NaO3S MolecularWeight: 270.27941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H12O3S.Na/c14-17(15,16)13-9-5-4-8-12(13)10-11-6-2-1-3-7-11;/h1-9H,10H2,(H,14,15,16);/q;+1/p-1