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sodium 2-methyl-3-(3-pentadecylphenoxy)propanoate

sodium 2-methyl-3-(3-pentadecylphenoxy)propanoate

Systemtic Name:sodium 2-methyl-3-(3-pentadecylphenoxy)propanoate
Openeye Name:sodium 2-methyl-3-(3-pentadecylphenoxy)propanoate
CAS Name:sodium 2-methyl-3-(3-pentadecylphenoxy)propanoate
IUPAC Name:sodium 2-methyl-3-(3-pentadecylphenoxy)propanoate
Traditional Name:sodium 2-methyl-3-(3-pentadecylphenoxy)propionate
Formula: C25H41NaO3
MolecularWeight: 412.58101
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OCC(C)C(=O)[O-].[Na+]


Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OCC(C)C(=O)[O-].[Na+]


InChI

InChI=1S/C25H42O3.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-23-18-16-19-24(20-23)28-21-22(2)25(26)27;/h16,18-20,22H,3-15,17,21H2,1-2H3,(H,26,27);/q;+1/p-1


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