2-methyl-1-[4-(2-methylcyclopenta[a]naphthalen-2-id-1-yl)butyl]cyclopenta[a]naphthalen-2-ide; zirconium(4+); dichloride

Systemtic Name: 2-methyl-1-[4-(2-methylcyclopenta[a]naphthalen-2-id-1-yl)butyl]cyclopenta[a]naphthalen-2-ide; zirconium(4+); dichloride Openeye Name: 2-methyl-1-[4-(2-methylcyclopenta[a]naphthalen-2-id-1-yl)butyl]cyclopenta[a]naphthalen-2-ide; zirconium(4+); dichloride CAS Name: 2-methyl-1-[4-(2-methyl-1-cyclopenta[a]naphthalen-2-idyl)butyl]cyclopenta[a]naphthalen-2-ide; zirconium(4+); dichloride IUPAC Name: 2-methyl-1-[4-(2-methylcyclopenta[a]naphthalen-2-id-1-yl)butyl]cyclopenta[a]naphthalen-2-ide; zirconium(4+); dichloride Traditional Name: 2-methyl-1-[4-(2-methylbenz[e]inden-2-id-1-yl)butyl]benz[e]inden-2-ide; zirconium(4+); dichloride Formula: C32H28Cl2Zr MolecularWeight: 574.69472

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C=C2C=CC3=CC=CC=C3C2=C1CCCCC4=C5C(=C[C-]4C)C=CC6=CC=CC=C65.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C[C-]1C=C2C=CC3=CC=CC=C3C2=C1CCCCC4=C5C(=C[C-]4C)C=CC6=CC=CC=C65.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C32H28.2ClH.Zr/c1-21-19-25-17-15-23-9-3-5-13-29(23)31(25)27(21)11-7-8-12-28-22(2)20-26-18-16-24-10-4-6-14-30(24)32(26)28;;;/h3-6,9-10,13-20H,7-8,11-12H2,1-2H3;2*1H;/q-2;;;+4/p-2