carbanide; cyclopentane; 2-methyl-1-[(2-methylpropan-2-yl)oxy]prop-1-en-1-ol; zirconium(3+)

Systemtic Name: carbanide; cyclopentane; 2-methyl-1-[(2-methylpropan-2-yl)oxy]prop-1-en-1-ol; zirconium(3+) Openeye Name: 1-tert-butoxy-2-methyl-prop-1-en-1-ol; carbanide; cyclopentane; zirconium(3+) CAS Name: carbanide; cyclopentane; 2-methyl-1-[(2-methylpropan-2-yl)oxy]-1-propen-1-ol; zirconium(3+) IUPAC Name: carbanide; cyclopentane; 2-methyl-1-[(2-methylpropan-2-yl)oxy]prop-1-en-1-ol; zirconium(3+) Traditional Name: 1-tert-butoxy-2-methyl-prop-1-en-1-ol; carbanide; cyclopentane; zirconium(3+) Formula: C19H29O2Zr+2 MolecularWeight: 380.65636

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].CC(=C(O)OC(C)(C)C)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+3]

Isomeric SMILES

[CH3-].CC(=C(O)OC(C)(C)C)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+3]

InChI

InChI=1S/C8H16O2.2C5H5.CH3.Zr/c1-6(2)7(9)10-8(3,4)5;2*1-2-4-5-3-1;;/h9H,1-5H3;2*1-5H;1H3;/q;;;-1;+3