sodium 4-carboxy-2-[3-[2-(2,2-dimethylpropanoyloxy)ethoxy]-2,2-dimethyl-3-oxidanylidene-propyl]hexanoate

Systemtic Name: sodium 4-carboxy-2-[3-[2-(2,2-dimethylpropanoyloxy)ethoxy]-2,2-dimethyl-3-oxidanylidene-propyl]hexanoate Openeye Name: sodium 4-carboxy-2-[3-[2-(2,2-dimethylpropanoyloxy)ethoxy]-2,2-dimethyl-3-oxo-propyl]hexanoate CAS Name: sodium 4-carboxy-2-[3-[2-(2,2-dimethyl-1-oxopropoxy)ethoxy]-2,2-dimethyl-3-oxopropyl]hexanoate IUPAC Name: sodium 4-carboxy-2-[3-[2-(2,2-dimethylpropanoyloxy)ethoxy]-2,2-dimethyl-3-oxopropyl]hexanoate Traditional Name: sodium 4-carboxy-2-[3-keto-2,2-dimethyl-3-(2-pivaloyloxyethoxy)propyl]hexanoate Formula: C19H31NaO8 MolecularWeight: 410.43441

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32O8.Na/c1-7-12(14(20)21)10-13(15(22)23)11-19(5,6)17(25)27-9-8-26-16(24)18(2,3)4;/h12-13H,7-11H2,1-6H3,(H,20,21)(H,22,23);/q;+1/p-1