2-methylcyclopenta-1,3-diene; 2-methylpent-4-en-2-olate; zirconium(4+)

Systemtic Name: 2-methylcyclopenta-1,3-diene; 2-methylpent-4-en-2-olate; zirconium(4+) Openeye Name: 2-methylcyclopenta-1,3-diene; 2-methylpent-4-en-2-olate; zirconium(4+) CAS Name: 2-methylcyclopenta-1,3-diene; 2-methyl-4-penten-2-olate; zirconium(4+) IUPAC Name: 2-methylcyclopenta-1,3-diene; 2-methylpent-4-en-2-olate; zirconium(4+) Traditional Name: 2-methylcyclopenta-1,3-diene; 2-methylpent-4-en-2-olate; zirconium(4+) Formula: C24H40O3Zr MolecularWeight: 467.7966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]CC=C1.CC(C)(CC=C)[O-].CC(C)(CC=C)[O-].CC(C)(CC=C)[O-].[Zr+4]

Isomeric SMILES

CC1=[C-]CC=C1.CC(C)(CC=C)[O-].CC(C)(CC=C)[O-].CC(C)(CC=C)[O-].[Zr+4]

InChI

InChI=1S/3C6H11O.C6H7.Zr/c3*1-4-5-6(2,3)7;1-6-4-2-3-5-6;/h3*4H,1,5H2,2-3H3;2,4H,3H2,1H3;/q4*-1;+4