methyl (2E)-2-[(4-fluorophenyl)-iodanyl-methylidene]-4-methyl-3-oxidanylidene-pentanoate

Systemtic Name: methyl (2E)-2-[(4-fluorophenyl)-iodanyl-methylidene]-4-methyl-3-oxidanylidene-pentanoate Openeye Name: methyl (2E)-2-[(4-fluorophenyl)-iodo-methylene]-4-methyl-3-oxo-pentanoate CAS Name: (2E)-2-[(4-fluorophenyl)-iodomethylidene]-4-methyl-3-oxopentanoic acid methyl ester IUPAC Name: methyl (2E)-2-[(4-fluorophenyl)-iodomethylidene]-4-methyl-3-oxopentanoate Traditional Name: (E)-3-(4-fluorophenyl)-3-iodo-2-isobutyryl-acrylic acid methyl ester Formula: C14H14FIO3 MolecularWeight: 376.162033

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(=C(C1=CC=C(C=C1)F)I)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H14FIO3/c1-8(2)13(17)11(14(18)19-3)12(16)9-4-6-10(15)7-5-9/h4-8H,1-3H3/b12-11+