(2E)-2-[(4-fluorophenyl)methylidene]-4-methyl-3-oxidanylidene-pentanoic acid

Systemtic Name: (2E)-2-[(4-fluorophenyl)methylidene]-4-methyl-3-oxidanylidene-pentanoic acid Openeye Name: (2E)-2-[(4-fluorophenyl)methylene]-4-methyl-3-oxo-pentanoic acid CAS Name: (2E)-2-[(4-fluorophenyl)methylidene]-4-methyl-3-oxopentanoic acid IUPAC Name: (2E)-2-[(4-fluorophenyl)methylidene]-4-methyl-3-oxopentanoic acid Traditional Name: (E)-3-(4-fluorophenyl)-2-isobutyryl-acrylic acid Formula: C13H13FO3 MolecularWeight: 236.238923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(=CC1=CC=C(C=C1)F)C(=O)O

Isomeric SMILES

CC(C)C(=O)/C(=C\C1=CC=C(C=C1)F)/C(=O)O

InChI

InChI=1S/C13H13FO3/c1-8(2)12(15)11(13(16)17)7-9-3-5-10(14)6-4-9/h3-8H,1-2H3,(H,16,17)/b11-7+