1-butyl-3-[2-(3-butyl-2-methyl-7-phenyl-3H-inden-1-yl)ethyl]-2-methyl-4-phenyl-1H-indene; zirconium(2+)

Systemtic Name: 1-butyl-3-[2-(3-butyl-2-methyl-7-phenyl-3H-inden-1-yl)ethyl]-2-methyl-4-phenyl-1H-indene; zirconium(2+) Openeye Name: 1-butyl-3-[2-(3-butyl-2-methyl-7-phenyl-3H-inden-1-yl)ethyl]-2-methyl-4-phenyl-1H-indene; zirconium(2+) CAS Name: 1-butyl-3-[2-(3-butyl-2-methyl-7-phenyl-3H-inden-1-yl)ethyl]-2-methyl-4-phenyl-1H-indene; zirconium(2+) IUPAC Name: 1-butyl-3-[2-(3-butyl-2-methyl-7-phenyl-3H-inden-1-yl)ethyl]-2-methyl-4-phenyl-1H-indene; zirconium(2+) Traditional Name: 1-butyl-3-[2-(3-butyl-2-methyl-7-phenyl-3H-inden-1-yl)ethyl]-2-methyl-4-phenyl-1H-indene; zirconium(2+) Formula: C42H44Zr MolecularWeight: 640.02276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2C1CCC[CH2-])C3=CC=CC=C3)CCC4=C(C(C5=CC=CC(=C54)C6=CC=CC=C6)CCC[CH2-])C.[Zr+2]

Isomeric SMILES

CC1=C(C2=C(C=CC=C2C1CCC[CH2-])C3=CC=CC=C3)CCC4=C(C(C5=CC=CC(=C54)C6=CC=CC=C6)CCC[CH2-])C.[Zr+2]

InChI

InChI=1S/C42H44.Zr/c1-5-7-21-33-29(3)35(41-37(23-15-25-39(33)41)31-17-11-9-12-18-31)27-28-36-30(4)34(22-8-6-2)40-26-16-24-38(42(36)40)32-19-13-10-14-20-32;/h9-20,23-26,33-34H,1-2,5-8,21-22,27-28H2,3-4H3;/q-2;+2