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

Systemtic Name: bis(oxidanidyl)-oxidanylidene-titanium; methylbenzene; methylbenzene Openeye Name: dioxido(oxo)titanium; methylbenzene; toluene CAS Name: dioxido(oxo)titanium; methylbenzene; toluene IUPAC Name: dioxido(oxo)titanium; methylbenzene; toluene Traditional Name: keto(dioxido)titanium; methylbenzene; toluene Formula: C28H29O3Ti-5 MolecularWeight: 461.39506

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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/C7H8.3C7H7.3O.Ti/c4*1-7-5-3-2-4-6-7;;;;/h2-6H,1H3;3*2-5H,1H3;;;;/q;3*-1;;2*-1;