methylbenzene; oxidanyl(oxidanylidene)titanium; hydrate

Systemtic Name: methylbenzene; oxidanyl(oxidanylidene)titanium; hydrate Openeye Name: hydroxy(oxo)titanium; methylbenzene; hydrate CAS Name: hydroxy(oxo)titanium; methylbenzene; hydrate IUPAC Name: hydroxy(oxo)titanium; methylbenzene; hydrate Traditional Name: hydroxy(keto)titanium; methylbenzene; hydrate Formula: C28H31O3Ti-4 MolecularWeight: 463.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.O.O[Ti]=O

Isomeric SMILES

CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.O.O[Ti]=O

InChI

InChI=1S/4C7H7.2H2O.O.Ti/c4*1-7-5-3-2-4-6-7;;;;/h4*2-5H,1H3;2*1H2;;/q4*-1;;;;+1/p-1