bis(oxidanyl)-oxidanylidene-titanium; methylbenzene; methylbenzene

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; methylbenzene; methylbenzene Openeye Name: dihydroxy(oxo)titanium; methylbenzene; toluene CAS Name: dihydroxy(oxo)titanium; methylbenzene; toluene IUPAC Name: dihydroxy(oxo)titanium; methylbenzene; toluene Traditional Name: dihydroxy(keto)titanium; methylbenzene; toluene Formula: C28H31O3Ti-3 MolecularWeight: 463.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.O[Ti](=O)O

Isomeric SMILES

CC1=CC=CC=C1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.CC1=CC=CC=[C-]1.O[Ti](=O)O

InChI

InChI=1S/C7H8.3C7H7.2H2O.O.Ti/c4*1-7-5-3-2-4-6-7;;;;/h2-6H,1H3;3*2-5H,1H3;2*1H2;;/q;3*-1;;;;+2/p-2