1,2,3,4,5-pentamethylcyclopentane; 4-prop-2-enylcyclopentene-1,2-diol; zirconium

Systemtic Name: 1,2,3,4,5-pentamethylcyclopentane; 4-prop-2-enylcyclopentene-1,2-diol; zirconium Openeye Name: 4-allylcyclopentene-1,2-diol; 1,2,3,4,5-pentamethylcyclopentane; zirconium CAS Name: 1,2,3,4,5-pentamethylcyclopentane; 4-prop-2-enylcyclopentene-1,2-diol; zirconium IUPAC Name: 1,2,3,4,5-pentamethylcyclopentane; 4-prop-2-enylcyclopentene-1,2-diol; zirconium Traditional Name: 4-allylcyclopentene-1,2-diol; 1,2,3,4,5-pentamethylcyclopentane; zirconium Formula: C28H42O2Zr MolecularWeight: 501.85588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[C]1[C]([C]([C]([C]1C)C)C)C.C[C]1[C]([C]([C]([C]1C)C)C)C.C=CCC1CC(=C(C1)O)O.[Zr]

Isomeric SMILES

C[C]1[C]([C]([C]([C]1C)C)C)C.C[C]1[C]([C]([C]([C]1C)C)C)C.C=CCC1CC(=C(C1)O)O.[Zr]

InChI

InChI=1S/2C10H15.C8H12O2.Zr/c2*1-6-7(2)9(4)10(5)8(6)3;1-2-3-6-4-7(9)8(10)5-6;/h2*1-5H3;2,6,9-10H,1,3-5H2;