N,N-diethylcarbamate; 1H-inden-1-ide; zirconium(3+)

Systemtic Name: N,N-diethylcarbamate; 1H-inden-1-ide; zirconium(3+) Openeye Name: N,N-diethylcarbamate; 1H-inden-1-ide; zirconium(3+) CAS Name: N,N-diethylcarbamate; 1H-inden-1-ide; zirconium(3+) IUPAC Name: N,N-diethylcarbamate; 1H-inden-1-ide; zirconium(3+) Traditional Name: N,N-diethylcarbamate; 1H-inden-1-ide; zirconium(3+) Formula: C24H37N3O6Zr- MolecularWeight: 554.79108

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)[O-].CCN(CC)C(=O)[O-].CCN(CC)C(=O)[O-].[CH-]1C=CC2=CC=CC=C21.[Zr+3]

Isomeric SMILES

CCN(CC)C(=O)[O-].CCN(CC)C(=O)[O-].CCN(CC)C(=O)[O-].[CH-]1C=CC2=CC=CC=C21.[Zr+3]

InChI

InChI=1S/C9H7.3C5H11NO2.Zr/c1-2-5-9-7-3-6-8(9)4-1;3*1-3-6(4-2)5(7)8;/h1-7H;3*3-4H2,1-2H3,(H,7,8);/q-1;;;;+3/p-3