sodium 3-methylpentanedioate

Systemtic Name: sodium 3-methylpentanedioate Openeye Name: sodium 3-methylpentanedioate CAS Name: sodium 3-methylpentanedioate IUPAC Name: sodium 3-methylpentanedioate Traditional Name: sodium 3-methylglutarate Formula: C6H8NaO4- MolecularWeight: 167.11509

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H10O4.Na/c1-4(2-5(7)8)3-6(9)10;/h4H,2-3H2,1H3,(H,7,8)(H,9,10);/q;+1/p-2