sodium 2-oxidanyl-3,5-di(propan-2-yl)benzoate

Systemtic Name: sodium 2-oxidanyl-3,5-di(propan-2-yl)benzoate Openeye Name: sodium 2-hydroxy-3,5-diisopropyl-benzoate CAS Name: sodium 2-hydroxy-3,5-di(propan-2-yl)benzoate IUPAC Name: sodium 2-hydroxy-3,5-di(propan-2-yl)benzoate Traditional Name: sodium 2-hydroxy-3,5-diisopropyl-benzoate Formula: C13H17NaO3 MolecularWeight: 244.26205

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3.Na/c1-7(2)9-5-10(8(3)4)12(14)11(6-9)13(15)16;/h5-8,14H,1-4H3,(H,15,16);/q;+1/p-1