sodium 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-3-fluoranyl-phenyl]-3,3-dimethyl-4-oxidanyl-butanoate

Systemtic Name: sodium 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-3-fluoranyl-phenyl]-3,3-dimethyl-4-oxidanyl-butanoate Openeye Name: sodium 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-3-fluoro-phenyl]-4-hydroxy-3,3-dimethyl-butanoate CAS Name: sodium 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-3-fluorophenyl]-4-hydroxy-3,3-dimethylbutanoate IUPAC Name: sodium 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-3-fluorophenyl]-4-hydroxy-3,3-dimethylbutanoate Traditional Name: sodium 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-3-fluoro-phenyl]-4-hydroxy-3,3-dimethyl-butyrate Formula: C26H32FNaO7 MolecularWeight: 498.516253

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C=C(C=C2)C(C(C)(C)CC(=O)[O-])O)F.[Na+]

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C=C(C=C2)C(C(C)(C)CC(=O)[O-])O)F.[Na+]

InChI

InChI=1S/C26H33FO7.Na/c1-5-7-19-21(11-9-18(16(2)28)24(19)31)33-12-6-13-34-22-10-8-17(14-20(22)27)25(32)26(3,4)15-23(29)30;/h8-11,14,25,31-32H,5-7,12-13,15H2,1-4H3,(H,29,30);/q;+1/p-1