methanol; 1,2,4,5,5-pentamethylcyclopenta-1,3-diene; titanium

Systemtic Name: methanol; 1,2,4,5,5-pentamethylcyclopenta-1,3-diene; titanium Openeye Name: methanol; 1,2,4,5,5-pentamethylcyclopenta-1,3-diene; titanium CAS Name: methanol; 1,2,4,5,5-pentamethylcyclopenta-1,3-diene; titanium IUPAC Name: methanol; 1,2,4,5,5-pentamethylcyclopenta-1,3-diene; titanium Traditional Name: methanol; 1,2,4,5,5-pentamethylcyclopenta-1,3-diene; titanium Formula: C13H27O3Ti- MolecularWeight: 279.21868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[C-]C(=C(C1(C)C)C)C.CO.CO.CO.[Ti]

Isomeric SMILES

CC1=[C-]C(=C(C1(C)C)C)C.CO.CO.CO.[Ti]

InChI

InChI=1S/C10H15.3CH4O.Ti/c1-7-6-8(2)10(4,5)9(7)3;3*1-2;/h1-5H3;3*2H,1H3;/q-1;;;;