(E)-7-[4-(4-fluorophenyl)-6-propan-2-yl-1,3-benzodioxol-5-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid

Systemtic Name: (E)-7-[4-(4-fluorophenyl)-6-propan-2-yl-1,3-benzodioxol-5-yl]-5-oxidanyl-3-oxidanylidene-hept-6-enoic acid Openeye Name: (E)-7-[4-(4-fluorophenyl)-6-isopropyl-1,3-benzodioxol-5-yl]-5-hydroxy-3-oxo-hept-6-enoic acid CAS Name: (E)-7-[4-(4-fluorophenyl)-6-propan-2-yl-1,3-benzodioxol-5-yl]-5-hydroxy-3-oxo-6-heptenoic acid IUPAC Name: (E)-7-[4-(4-fluorophenyl)-6-propan-2-yl-1,3-benzodioxol-5-yl]-5-hydroxy-3-oxohept-6-enoic acid Traditional Name: (E)-7-[4-(4-fluorophenyl)-6-isopropyl-1,3-benzodioxol-5-yl]-5-hydroxy-3-keto-hept-6-enoic acid Formula: C23H23FO6 MolecularWeight: 414.423523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C(=C1C=CC(CC(=O)CC(=O)O)O)C3=CC=C(C=C3)F)OCO2

Isomeric SMILES

CC(C)C1=CC2=C(C(=C1/C=C/C(CC(=O)CC(=O)O)O)C3=CC=C(C=C3)F)OCO2

InChI

InChI=1S/C23H23FO6/c1-13(2)19-11-20-23(30-12-29-20)22(14-3-5-15(24)6-4-14)18(19)8-7-16(25)9-17(26)10-21(27)28/h3-8,11,13,16,25H,9-10,12H2,1-2H3,(H,27,28)/b8-7+