2-ethyl-3-[2-(2-ethyl-7-phenyl-3H-inden-3-id-1-yl)cyclohexyl]-4-phenyl-1H-inden-1-ide; titanium(4+); dichloride

Systemtic Name: 2-ethyl-3-[2-(2-ethyl-7-phenyl-3H-inden-3-id-1-yl)cyclohexyl]-4-phenyl-1H-inden-1-ide; titanium(4+); dichloride Openeye Name: 2-ethyl-3-[2-(2-ethyl-7-phenyl-3H-inden-3-id-1-yl)cyclohexyl]-4-phenyl-1H-inden-1-ide; titanium(4+); dichloride CAS Name: 2-ethyl-3-[2-(2-ethyl-7-phenyl-3H-inden-3-id-1-yl)cyclohexyl]-4-phenyl-1H-inden-1-ide; titanium(4+); dichloride IUPAC Name: 2-ethyl-3-[2-(2-ethyl-7-phenyl-3H-inden-3-id-1-yl)cyclohexyl]-4-phenyl-1H-inden-1-ide; titanium(4+); dichloride Traditional Name: 2-ethyl-3-[2-(2-ethyl-7-phenyl-3H-inden-3-id-1-yl)cyclohexyl]-4-phenyl-1H-inden-1-ide; titanium(4+); dichloride Formula: C40H38Cl2Ti MolecularWeight: 637.50272

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C4CCCCC4C5=C([CH-]C6=C5C(=CC=C6)C7=CC=CC=C7)CC.[Cl-].[Cl-].[Ti+4]

Isomeric SMILES

CCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C4CCCCC4C5=C([CH-]C6=C5C(=CC=C6)C7=CC=CC=C7)CC.[Cl-].[Cl-].[Ti+4]

InChI

InChI=1S/C40H38.2ClH.Ti/c1-3-27-25-31-19-13-23-33(29-15-7-5-8-16-29)39(31)37(27)35-21-11-12-22-36(35)38-28(4-2)26-32-20-14-24-34(40(32)38)30-17-9-6-10-18-30;;;/h5-10,13-20,23-26,35-36H,3-4,11-12,21-22H2,1-2H3;2*1H;/q-2;;;+4/p-2