sodium 13-(4-hydroxyphenyl)tridecanoate

Systemtic Name: sodium 13-(4-hydroxyphenyl)tridecanoate Openeye Name: sodium 13-(4-hydroxyphenyl)tridecanoate CAS Name: sodium 13-(4-hydroxyphenyl)tridecanoate IUPAC Name: sodium 13-(4-hydroxyphenyl)tridecanoate Traditional Name: sodium 13-(4-hydroxyphenyl)tridecanoate Formula: C19H29NaO3 MolecularWeight: 328.42153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCCCCCCCCC(=O)[O-])O.[Na+]

Isomeric SMILES

C1=CC(=CC=C1CCCCCCCCCCCCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C19H30O3.Na/c20-18-15-13-17(14-16-18)11-9-7-5-3-1-2-4-6-8-10-12-19(21)22;/h13-16,20H,1-12H2,(H,21,22);/q;+1/p-1