sodium 8-[bis(4-fluoranyl-3-methyl-phenyl)methylidene]-9-methyl-3,5-bis(oxidanyl)decanoate

Systemtic Name: sodium 8-[bis(4-fluoranyl-3-methyl-phenyl)methylidene]-9-methyl-3,5-bis(oxidanyl)decanoate Openeye Name: sodium 8-[bis(4-fluoro-3-methyl-phenyl)methylene]-3,5-dihydroxy-9-methyl-decanoate CAS Name: sodium 8-[bis(4-fluoro-3-methylphenyl)methylidene]-3,5-dihydroxy-9-methyldecanoate IUPAC Name: sodium 8-[bis(4-fluoro-3-methylphenyl)methylidene]-3,5-dihydroxy-9-methyldecanoate Traditional Name: sodium 9,9-bis(4-fluoro-3-methyl-phenyl)-3,5-dihydroxy-8-isopropyl-non-8-enoate Formula: C26H31F2NaO4 MolecularWeight: 468.508516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=C(CCC(CC(CC(=O)[O-])O)O)C(C)C)C2=CC(=C(C=C2)F)C)F.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=C(CCC(CC(CC(=O)[O-])O)O)C(C)C)C2=CC(=C(C=C2)F)C)F.[Na+]

InChI

InChI=1S/C26H32F2O4.Na/c1-15(2)22(8-7-20(29)13-21(30)14-25(31)32)26(18-5-9-23(27)16(3)11-18)19-6-10-24(28)17(4)12-19;/h5-6,9-12,15,20-21,29-30H,7-8,13-14H2,1-4H3,(H,31,32);/q;+1/p-1