bis(chloranyl)zirconium(2+); methyl-bis[2-methyl-4-(4-phenoxyphenyl)-4H-azulen-1-id-1-yl]-naphthalen-1-yl-silane

Systemtic Name: bis(chloranyl)zirconium(2+); methyl-bis[2-methyl-4-(4-phenoxyphenyl)-4H-azulen-1-id-1-yl]-naphthalen-1-yl-silane Openeye Name: dichlorozirconium(2+); methyl-bis[2-methyl-4-(4-phenoxyphenyl)-4H-azulen-1-id-1-yl]-(1-naphthyl)silane CAS Name: dichlorozirconium(2+); methyl-bis[2-methyl-4-(4-phenoxyphenyl)-4H-azulen-1-id-1-yl]-(1-naphthalenyl)silane IUPAC Name: dichlorozirconium(2+); methyl-bis[2-methyl-4-(4-phenoxyphenyl)-4H-azulen-1-id-1-yl]-naphthalen-1-ylsilane Traditional Name: dichlorozirconium(2+); methyl-bis[2-methyl-4-(4-phenoxyphenyl)-4H-azulen-1-id-1-yl]-(1-naphthyl)silane Formula: C57H46Cl2O2SiZr MolecularWeight: 953.18944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([C-]1[Si](C)([C-]3C(=CC4=C3C=CC=CC4C5=CC=C(C=C5)OC6=CC=CC=C6)C)C7=CC=CC8=CC=CC=C87)C=CC=CC2C9=CC=C(C=C9)OC1=CC=CC=C1.Cl[Zr+2]Cl

Isomeric SMILES

CC1=CC2=C([C-]1[Si](C)([C-]3C(=CC4=C3C=CC=CC4C5=CC=C(C=C5)OC6=CC=CC=C6)C)C7=CC=CC8=CC=CC=C87)C=CC=CC2C9=CC=C(C=C9)OC1=CC=CC=C1.Cl[Zr+2]Cl

InChI

InChI=1S/C57H46O2Si.2ClH.Zr/c1-39-37-53-48(42-29-33-46(34-30-42)58-44-19-6-4-7-20-44)23-12-14-26-51(53)56(39)60(3,55-28-16-18-41-17-10-11-25-50(41)55)57-40(2)38-54-49(24-13-15-27-52(54)57)43-31-35-47(36-32-43)59-45-21-8-5-9-22-45;;;/h4-38,48-49H,1-3H3;2*1H;/q-2;;;+4/p-2