butane; propan-1-ol; zirconium(2+); isocyanate

Systemtic Name: butane; propan-1-ol; zirconium(2+); isocyanate Openeye Name: butane; propan-1-ol; zirconium(2+); isocyanate CAS Name: butane; 1-propanol; zirconium(2+); isocyanate IUPAC Name: butane; propan-1-ol; zirconium(2+); isocyanate Traditional Name: butane; propan-1-ol; zirconium(2+); isocyanate Formula: C11H25NO3Zr MolecularWeight: 310.5451

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Descriptors Computed from Structure

Canonical SMILES:

CCCO.CCCO.CC[CH-]C.C(=[N-])=O.[Zr+2]

Isomeric SMILES

CCCO.CCCO.CC[CH-]C.C(=[N-])=O.[Zr+2]

InChI

InChI=1S/C4H9.2C3H8O.CNO.Zr/c1-3-4-2;2*1-2-3-4;2-1-3;/h3H,4H2,1-2H3;2*4H,2-3H2,1H3;;/q-1;;;-1;+2