sodium 2,6-dimethyl-4-oxidanyl-heptanoate

Systemtic Name: sodium 2,6-dimethyl-4-oxidanyl-heptanoate Openeye Name: sodium 4-hydroxy-2,6-dimethyl-heptanoate CAS Name: sodium 4-hydroxy-2,6-dimethylheptanoate IUPAC Name: sodium 4-hydroxy-2,6-dimethylheptanoate Traditional Name: sodium 4-hydroxy-2,6-dimethyl-enanthate Formula: C9H17NaO3 MolecularWeight: 196.21925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18O3.Na/c1-6(2)4-8(10)5-7(3)9(11)12;/h6-8,10H,4-5H2,1-3H3,(H,11,12);/q;+1/p-1