sodium 2-(3-ethyloctan-3-yl)butanedioate

Systemtic Name: sodium 2-(3-ethyloctan-3-yl)butanedioate Openeye Name: sodium 2-(1,1-diethylhexyl)butanedioate CAS Name: sodium 2-(3-ethyloctan-3-yl)butanedioate IUPAC Name: sodium 2-(3-ethyloctan-3-yl)butanedioate Traditional Name: sodium 2-(1,1-diethylhexyl)succinate Formula: C14H24NaO4- MolecularWeight: 279.32773

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H26O4.Na/c1-4-7-8-9-14(5-2,6-3)11(13(17)18)10-12(15)16;/h11H,4-10H2,1-3H3,(H,15,16)(H,17,18);/q;+1/p-2