2-butylcyclopenta-1,3-diene; methanoylazanide; zirconium(4+); chloride

Systemtic Name: 2-butylcyclopenta-1,3-diene; methanoylazanide; zirconium(4+); chloride Openeye Name: 2-butylcyclopenta-1,3-diene; formylazanide; zirconium(4+); chloride CAS Name: 2-butylcyclopenta-1,3-diene; formylazanide; zirconium(4+); chloride IUPAC Name: 2-butylcyclopenta-1,3-diene; formylazanide; zirconium(4+); chloride Traditional Name: 2-butylcyclopenta-1,3-diene; formylazanide; zirconium(4+); chloride Formula: C20H30ClN2O2Zr- MolecularWeight: 457.1414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.C(=O)[NH-].C(=O)[NH-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.C(=O)[NH-].C(=O)[NH-].[Cl-].[Zr+4]

InChI

InChI=1S/2C9H13.2CH3NO.ClH.Zr/c2*1-2-3-6-9-7-4-5-8-9;2*2-1-3;;/h2*4,7H,2-3,5-6H2,1H3;2*1H,(H2,2,3);1H;/q2*-1;;;;+4/p-3