2-butyl-1-[2-(2-butyl-7-phenyl-inden-2-id-1-yl)ethyl]-7-phenyl-inden-2-ide; titanium(4+); dichloride

Systemtic Name: 2-butyl-1-[2-(2-butyl-7-phenyl-inden-2-id-1-yl)ethyl]-7-phenyl-inden-2-ide; titanium(4+); dichloride Openeye Name: 2-butyl-1-[2-(2-butyl-7-phenyl-inden-2-id-1-yl)ethyl]-7-phenyl-inden-2-ide; titanium(4+); dichloride CAS Name: 2-butyl-1-[2-(2-butyl-7-phenyl-1-inden-2-idyl)ethyl]-7-phenylinden-2-ide; titanium(4+); dichloride IUPAC Name: 2-butyl-1-[2-(2-butyl-7-phenylinden-2-id-1-yl)ethyl]-7-phenylinden-2-ide; titanium(4+); dichloride Traditional Name: 2-butyl-1-[2-(2-butyl-7-phenyl-inden-2-id-1-yl)ethyl]-7-phenyl-inden-2-ide; titanium(4+); dichloride Formula: C40H40Cl2Ti MolecularWeight: 639.5186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[C-]1C=C2C=CC=C(C2=C1CCC3=C4C(=C[C-]3CCCC)C=CC=C4C5=CC=CC=C5)C6=CC=CC=C6.[Cl-].[Cl-].[Ti+4]

Isomeric SMILES

CCCC[C-]1C=C2C=CC=C(C2=C1CCC3=C4C(=C[C-]3CCCC)C=CC=C4C5=CC=CC=C5)C6=CC=CC=C6.[Cl-].[Cl-].[Ti+4]

InChI

InChI=1S/C40H40.2ClH.Ti/c1-3-5-15-31-27-33-21-13-23-35(29-17-9-7-10-18-29)39(33)37(31)25-26-38-32(16-6-4-2)28-34-22-14-24-36(40(34)38)30-19-11-8-12-20-30;;;/h7-14,17-24,27-28H,3-6,15-16,25-26H2,1-2H3;2*1H;/q-2;;;+4/p-2