butan-2-olate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(4+)

Systemtic Name: butan-2-olate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(4+) Openeye Name: butan-2-olate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(4+) CAS Name: 2-butanolate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(4+) IUPAC Name: butan-2-olate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(4+) Traditional Name: butan-2-olate; 1,2,3,5,5-pentamethylcyclopenta-1,3-diene; titanium(4+) Formula: C22H42O3Ti MolecularWeight: 402.43408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].CC1=[C-]C(C(=C1C)C)(C)C.[Ti+4]

Isomeric SMILES

CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].CC1=[C-]C(C(=C1C)C)(C)C.[Ti+4]

InChI

InChI=1S/C10H15.3C4H9O.Ti/c1-7-6-10(4,5)9(3)8(7)2;3*1-3-4(2)5;/h1-5H3;3*4H,3H2,1-2H3;/q4*-1;+4