2-(1H-inden-1-id-2-yl)-1-benzofuran; zirconium(4+); dichloride

Systemtic Name: 2-(1H-inden-1-id-2-yl)-1-benzofuran; zirconium(4+); dichloride Openeye Name: 2-(1H-inden-1-id-2-yl)benzofuran; zirconium(4+); dichloride CAS Name: 2-(1H-inden-1-id-2-yl)benzofuran; zirconium(4+); dichloride IUPAC Name: 2-(1H-inden-1-id-2-yl)-1-benzofuran; zirconium(4+); dichloride Traditional Name: 2-(1H-inden-1-id-2-yl)benzofuran; zirconium(4+); dichloride Formula: C34H22Cl2O2Zr MolecularWeight: 624.66728

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=CC=CC=C2C=C1C3=CC4=CC=CC=C4O3.[CH-]1C2=CC=CC=C2C=C1C3=CC4=CC=CC=C4O3.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH-]1C2=CC=CC=C2C=C1C3=CC4=CC=CC=C4O3.[CH-]1C2=CC=CC=C2C=C1C3=CC4=CC=CC=C4O3.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C17H11O.2ClH.Zr/c2*1-2-6-13-10-15(9-12(13)5-1)17-11-14-7-3-4-8-16(14)18-17;;;/h2*1-11H;2*1H;/q2*-1;;;+4/p-2