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sodium 4-carboxy-2,7,7-trimethyl-nonanoate

sodium 4-carboxy-2,7,7-trimethyl-nonanoate

Systemtic Name:sodium 4-carboxy-2,7,7-trimethyl-nonanoate
Openeye Name:sodium 4-carboxy-2,7,7-trimethyl-nonanoate
CAS Name:sodium 4-carboxy-2,7,7-trimethylnonanoate
IUPAC Name:sodium 4-carboxy-2,7,7-trimethylnonanoate
Traditional Name:sodium 4-carboxy-2,7,7-trimethyl-pelargonate
Formula: C13H23NaO4
MolecularWeight: 266.30909
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H24O4.Na/c1-5-13(3,4)7-6-10(12(16)17)8-9(2)11(14)15;/h9-10H,5-8H2,1-4H3,(H,14,15)(H,16,17);/q;+1/p-1


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