sodium 4-methylpentanoate

Systemtic Name: sodium 4-methylpentanoate Openeye Name: sodium 4-methylpentanoate CAS Name: sodium 4-methylpentanoate IUPAC Name: sodium 4-methylpentanoate Traditional Name: sodium 4-methylvalerate Formula: C6H11NaO2 MolecularWeight: 139.132765

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H12O2.Na/c1-5(2)3-4-6(7)8;/h5H,3-4H2,1-2H3,(H,7,8);/q;+1/p-1/i6+1;