sodium 3-methyl-2-oxidanylidene-3-phenyl-pentanoate

Systemtic Name: sodium 3-methyl-2-oxidanylidene-3-phenyl-pentanoate Openeye Name: sodium 3-methyl-2-oxo-3-phenyl-pentanoate CAS Name: sodium 3-methyl-2-oxo-3-phenylpentanoate IUPAC Name: sodium 3-methyl-2-oxo-3-phenylpentanoate Traditional Name: sodium 2-keto-3-methyl-3-phenyl-valerate Formula: C12H13NaO3 MolecularWeight: 228.21959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O3.Na/c1-3-12(2,10(13)11(14)15)9-7-5-4-6-8-9;/h4-8H,3H2,1-2H3,(H,14,15);/q;+1/p-1