4-fluoranylbenzoic acid; methanolate; titanium(2+)

Systemtic Name: 4-fluoranylbenzoic acid; methanolate; titanium(2+) Openeye Name: 4-fluorobenzoic acid; methanolate; titanium(2+) CAS Name: 4-fluorobenzoic acid; methanolate; titanium(2+) IUPAC Name: 4-fluorobenzoic acid; methanolate; titanium(2+) Traditional Name: 4-fluorobenzoic acid; methanolate; titanium(2+) Formula: C16H16F2O6Ti MolecularWeight: 390.158446

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Descriptors Computed from Structure

Canonical SMILES:

C[O-].C[O-].C1=CC(=CC=C1C(=O)O)F.C1=CC(=CC=C1C(=O)O)F.[Ti+2]

Isomeric SMILES

C[O-].C[O-].C1=CC(=CC=C1C(=O)O)F.C1=CC(=CC=C1C(=O)O)F.[Ti+2]

InChI

InChI=1S/2C7H5FO2.2CH3O.Ti/c2*8-6-3-1-5(2-4-6)7(9)10;2*1-2;/h2*1-4H,(H,9,10);2*1H3;/q;;2*-1;+2