benzene; methanol; 2-(2-phenyl-1H-inden-1-yl)-1H-naphthalen-1-ide; titanium(3+); dichloride

Systemtic Name: benzene; methanol; 2-(2-phenyl-1H-inden-1-yl)-1H-naphthalen-1-ide; titanium(3+); dichloride Openeye Name: benzene; methanol; 2-(2-phenyl-1H-inden-1-yl)-1H-naphthalen-1-ide; titanium(3+); dichloride CAS Name: benzene; methanol; 2-(2-phenyl-1H-inden-1-yl)-1H-naphthalen-1-ide; titanium(3+); dichloride IUPAC Name: benzene; methanol; 2-(2-phenyl-1H-inden-1-yl)-1H-naphthalen-1-ide; titanium(3+); dichloride Traditional Name: benzene; methanol; 2-(2-phenyl-1H-inden-1-yl)-1H-naphthalen-1-ide; titanium(3+); dichloride Formula: C38H31Cl2OTi-2 MolecularWeight: 622.42514

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Descriptors Computed from Structure

Canonical SMILES:

CO.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=C(C=C1)C2=CC3=CC=CC=C3C2C4=CC=C5C=CC=CC5=[C-]4.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CO.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.C1=CC=C(C=C1)C2=CC3=CC=CC=C3C2C4=CC=C5C=CC=CC5=[C-]4.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C25H17.2C6H5.CH4O.2ClH.Ti/c1-2-9-19(10-3-1)24-17-21-12-6-7-13-23(21)25(24)22-15-14-18-8-4-5-11-20(18)16-22;2*1-2-4-6-5-3-1;1-2;;;/h1-15,17,25H;2*1-5H;2H,1H3;2*1H;/q3*-1;;;;+3/p-2