butan-1-ol; (E)-4-ethoxy-1,1,1-tris(fluoranyl)-4-oxidanyl-but-3-en-2-one; zirconium

Systemtic Name: butan-1-ol; (E)-4-ethoxy-1,1,1-tris(fluoranyl)-4-oxidanyl-but-3-en-2-one; zirconium Openeye Name: butan-1-ol; (E)-4-ethoxy-1,1,1-trifluoro-4-hydroxy-but-3-en-2-one; zirconium CAS Name: 1-butanol; (E)-4-ethoxy-1,1,1-trifluoro-4-hydroxy-3-buten-2-one; zirconium IUPAC Name: butan-1-ol; (E)-4-ethoxy-1,1,1-trifluoro-4-hydroxybut-3-en-2-one; zirconium Traditional Name: butan-1-ol; (E)-4-ethoxy-1,1,1-trifluoro-4-hydroxy-but-3-en-2-one; zirconium Formula: C14H27F3O5Zr MolecularWeight: 423.58039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCO.CCCCO.CCOC(=CC(=O)C(F)(F)F)O.[Zr]

Isomeric SMILES

CCCCO.CCCCO.CCO/C(=C/C(=O)C(F)(F)F)/O.[Zr]

InChI

InChI=1S/C6H7F3O3.2C4H10O.Zr/c1-2-12-5(11)3-4(10)6(7,8)9;2*1-2-3-4-5;/h3,11H,2H2,1H3;2*5H,2-4H2,1H3;/b5-3+;;;