sodium 6-methyl-2-oxidanyl-3-propan-2-yl-benzoate

Systemtic Name: sodium 6-methyl-2-oxidanyl-3-propan-2-yl-benzoate Openeye Name: sodium 2-hydroxy-3-isopropyl-6-methyl-benzoate CAS Name: sodium 2-hydroxy-6-methyl-3-propan-2-ylbenzoate IUPAC Name: sodium 2-hydroxy-6-methyl-3-propan-2-ylbenzoate Traditional Name: sodium 2-hydroxy-3-isopropyl-6-methyl-benzoate Formula: C11H13NaO3 MolecularWeight: 216.20889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(C)C)O)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(C(=C(C=C1)C(C)C)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C11H14O3.Na/c1-6(2)8-5-4-7(3)9(10(8)12)11(13)14;/h4-6,12H,1-3H3,(H,13,14);/q;+1/p-1