(E)-4-oxidanylpent-3-en-2-one; zirconium

Systemtic Name: (E)-4-oxidanylpent-3-en-2-one; zirconium Openeye Name: (E)-4-hydroxypent-3-en-2-one; zirconium CAS Name: (E)-4-hydroxy-3-penten-2-one; zirconium IUPAC Name: (E)-4-hydroxypent-3-en-2-one; zirconium Traditional Name: (E)-4-hydroxypent-3-en-2-one; zirconium Formula: C20H32O8Zr MolecularWeight: 491.68728

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.CC(=CC(=O)C)O.[Zr]

Isomeric SMILES

C/C(=C\C(=O)C)/O.C/C(=C\C(=O)C)/O.C/C(=C\C(=O)C)/O.C/C(=C\C(=O)C)/O.[Zr]

InChI

InChI=1S/4C5H8O2.Zr/c4*1-4(6)3-5(2)7;/h4*3,6H,1-2H3;/b4*4-3+;