2-tert-butylindol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; titanium(3+); dichloride

Systemtic Name: 2-tert-butylindol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; titanium(3+); dichloride Openeye Name: 2-tert-butylindol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; titanium(3+); dichloride CAS Name: 2-tert-butylindol-1-ide; 5-methanidyl-1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium(3+); dichloride IUPAC Name: 2-tert-butylindol-1-ide; 5-methanidyl-1,2,3,5-tetramethylcyclopenta-1,3-diene; titanium(3+); dichloride Traditional Name: 2-tert-butylindol-1-ide; 5-methanidyl-1,2,3,5-tetramethyl-cyclopenta-1,3-diene; titanium(3+); dichloride Formula: C22H28Cl2NTi-2 MolecularWeight: 425.23742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(C(=C1C)C)(C)[CH2-].CC(C)(C)C1=CC2=CC=CC=C2[N-]1.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CC1=[C-]C(C(=C1C)C)(C)[CH2-].CC(C)(C)C1=CC2=CC=CC=C2[N-]1.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C12H14N.C10H14.2ClH.Ti/c1-12(2,3)11-8-9-6-4-5-7-10(9)13-11;1-7-6-10(4,5)9(3)8(7)2;;;/h4-8H,1-3H3;4H2,1-3,5H3;2*1H;/q-1;-2;;;+3/p-2