bis(3-butyl-2-naphthalen-1-yl-3H-inden-1-yl)-methyl-phenyl-silane; zirconium(2+)

Systemtic Name: bis(3-butyl-2-naphthalen-1-yl-3H-inden-1-yl)-methyl-phenyl-silane; zirconium(2+) Openeye Name: bis[3-butyl-2-(1-naphthyl)-3H-inden-1-yl]-methyl-phenyl-silane; zirconium(2+) CAS Name: bis[3-butyl-2-(1-naphthalenyl)-3H-inden-1-yl]-methyl-phenylsilane; zirconium(2+) IUPAC Name: bis(3-butyl-2-naphthalen-1-yl-3H-inden-1-yl)-methyl-phenylsilane; zirconium(2+) Traditional Name: bis[3-butyl-2-(1-naphthyl)-3H-inden-1-yl]-methyl-phenyl-silane; zirconium(2+) Formula: C53H48SiZr MolecularWeight: 804.25772

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C1=CC=CC=C1)(C2=C(C(C3=CC=CC=C32)CCC[CH2-])C4=CC=CC5=CC=CC=C54)C6=C(C(C7=CC=CC=C76)CCC[CH2-])C8=CC=CC9=CC=CC=C98.[Zr+2]

Isomeric SMILES

C[Si](C1=CC=CC=C1)(C2=C(C(C3=CC=CC=C32)CCC[CH2-])C4=CC=CC5=CC=CC=C54)C6=C(C(C7=CC=CC=C76)CCC[CH2-])C8=CC=CC9=CC=CC=C98.[Zr+2]

InChI

InChI=1S/C53H48Si.Zr/c1-4-6-27-46-42-31-15-17-33-48(42)52(50(46)44-35-19-23-37-21-11-13-29-40(37)44)54(3,39-25-9-8-10-26-39)53-49-34-18-16-32-43(49)47(28-7-5-2)51(53)45-36-20-24-38-22-12-14-30-41(38)45;/h8-26,29-36,46-47H,1-2,4-7,27-28H2,3H3;/q-2;+2