butan-1-ol; (Z)-4-oxidanylidenepent-2-en-2-olate; zirconium

Systemtic Name: butan-1-ol; (Z)-4-oxidanylidenepent-2-en-2-olate; zirconium Openeye Name: butan-1-ol; (Z)-4-oxopent-2-en-2-olate; zirconium CAS Name: 1-butanol; (Z)-4-oxo-2-penten-2-olate; zirconium IUPAC Name: butan-1-ol; (Z)-4-oxopent-2-en-2-olate; zirconium Traditional Name: butan-1-ol; (Z)-4-ketopent-2-en-2-olate; zirconium Formula: C26H54O8Zr2-2 MolecularWeight: 677.15016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCO.CCCCO.CCCCO.CCCCO.C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].[Zr].[Zr]

InChI

InChI=1S/2C5H8O2.4C4H10O.2Zr/c2*1-4(6)3-5(2)7;4*1-2-3-4-5;;/h2*3,6H,1-2H3;4*5H,2-4H2,1H3;;/p-2/b2*4-3-;;;;;;