2-(1,2-dihydroinden-2-id-1-yl)-5-methyl-furan; zirconium(4+); dichloride

Systemtic Name: 2-(1,2-dihydroinden-2-id-1-yl)-5-methyl-furan; zirconium(4+); dichloride Openeye Name: 2-(1,2-dihydroinden-2-id-1-yl)-5-methyl-furan; zirconium(4+); dichloride CAS Name: 2-(1,2-dihydroinden-2-id-1-yl)-5-methylfuran; zirconium(4+); dichloride IUPAC Name: 2-(1,2-dihydroinden-2-id-1-yl)-5-methylfuran; zirconium(4+); dichloride Traditional Name: 2-(1,2-dihydroinden-2-id-1-yl)-5-methyl-furan; zirconium(4+); dichloride Formula: C28H22Cl2O2Zr MolecularWeight: 552.60308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2[C-]=CC3=CC=CC=C23.CC1=CC=C(O1)C2[C-]=CC3=CC=CC=C23.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=CC=C(O1)C2[C-]=CC3=CC=CC=C23.CC1=CC=C(O1)C2[C-]=CC3=CC=CC=C23.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C14H11O.2ClH.Zr/c2*1-10-6-9-14(15-10)13-8-7-11-4-2-3-5-12(11)13;;;/h2*2-7,9,13H,1H3;2*1H;/q2*-1;;;+4/p-2