sodium 4-methoxy-2,6-dimethyl-benzenesulfonate

Systemtic Name: sodium 4-methoxy-2,6-dimethyl-benzenesulfonate Openeye Name: sodium 4-methoxy-2,6-dimethyl-benzenesulfonate CAS Name: sodium 4-methoxy-2,6-dimethylbenzenesulfonate IUPAC Name: sodium 4-methoxy-2,6-dimethylbenzenesulfonate Traditional Name: sodium 4-methoxy-2,6-dimethyl-besylate Formula: C9H11NaO4S MolecularWeight: 238.23601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)[O-])C)OC.[Na+]

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)[O-])C)OC.[Na+]

InChI

InChI=1S/C9H12O4S.Na/c1-6-4-8(13-3)5-7(2)9(6)14(10,11)12;/h4-5H,1-3H3,(H,10,11,12);/q;+1/p-1