3-ethyl-4-methyl-hexan-3-ol; zirconium; isocyanate

Systemtic Name: 3-ethyl-4-methyl-hexan-3-ol; zirconium; isocyanate Openeye Name: 3-ethyl-4-methyl-hexan-3-ol; zirconium; isocyanate CAS Name: 3-ethyl-4-methyl-3-hexanol; zirconium; isocyanate IUPAC Name: 3-ethyl-4-methylhexan-3-ol; zirconium; isocyanate Traditional Name: 3-ethyl-4-methyl-hexan-3-ol; zirconium; isocyanate Formula: C10H20NO2Zr- MolecularWeight: 277.4953

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC)(CC)O.C(=[N-])=O.[Zr]

Isomeric SMILES

CCC(C)C(CC)(CC)O.C(=[N-])=O.[Zr]

InChI

InChI=1S/C9H20O.CNO.Zr/c1-5-8(4)9(10,6-2)7-3;2-1-3;/h8,10H,5-7H2,1-4H3;;/q;-1;