sodium 4-(4-hexoxyphenyl)-4-oxidanyl-butanoate

Systemtic Name: sodium 4-(4-hexoxyphenyl)-4-oxidanyl-butanoate Openeye Name: sodium 4-(4-hexoxyphenyl)-4-hydroxy-butanoate CAS Name: sodium 4-(4-hexoxyphenyl)-4-hydroxybutanoate IUPAC Name: sodium 4-(4-hexoxyphenyl)-4-hydroxybutanoate Traditional Name: sodium 4-(4-hexoxyphenyl)-4-hydroxy-butyrate Formula: C16H23NaO4 MolecularWeight: 302.34119

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(CCC(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(CCC(=O)[O-])O.[Na+]

InChI

InChI=1S/C16H24O4.Na/c1-2-3-4-5-12-20-14-8-6-13(7-9-14)15(17)10-11-16(18)19;/h6-9,15,17H,2-5,10-12H2,1H3,(H,18,19);/q;+1/p-1