sodium 3-methylbutanoate

Systemtic Name: sodium 3-methylbutanoate Openeye Name: sodium 3-methylbutanoate CAS Name: sodium 3-methylbutanoate IUPAC Name: sodium 3-methylbutanoate Traditional Name: sodium 3-methylbutyrate Formula: C5H9NaO2 MolecularWeight: 125.106185

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[13C](=O)[O-].[Na+]

InChI

InChI=1S/C5H10O2.Na/c1-4(2)3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);/q;+1/p-1/i5+1;