(E)-7-[2-tert-butyl-4-(4-fluorophenyl)-5-phenyl-furan-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid

Systemtic Name: (E)-7-[2-tert-butyl-4-(4-fluorophenyl)-5-phenyl-furan-3-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid Openeye Name: (E)-7-[2-tert-butyl-4-(4-fluorophenyl)-5-phenyl-3-furyl]-5-hydroxy-3-oxo-hept-6-enoic acid CAS Name: (E)-7-[2-tert-butyl-4-(4-fluorophenyl)-5-phenyl-3-furanyl]-5-hydroxy-3-oxo-6-heptenoic acid IUPAC Name: (E)-7-[2-tert-butyl-4-(4-fluorophenyl)-5-phenylfuran-3-yl]-5-hydroxy-3-oxohept-6-enoic acid Traditional Name: (E)-7-[2-tert-butyl-4-(4-fluorophenyl)-5-phenyl-3-furyl]-5-hydroxy-3-keto-hept-6-enoic acid Formula: C27H27FO5 MolecularWeight: 450.498683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=C(C=C3)F)C=CC(CC(=O)CC(=O)O)O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=C(C=C3)F)/C=C/C(CC(=O)CC(=O)O)O

InChI

InChI=1S/C27H27FO5/c1-27(2,3)26-22(14-13-20(29)15-21(30)16-23(31)32)24(17-9-11-19(28)12-10-17)25(33-26)18-7-5-4-6-8-18/h4-14,20,29H,15-16H2,1-3H3,(H,31,32)/b14-13+