(Z)-4-oxidanylidenepent-2-en-2-olate; propane-1,3-diolate; titanium(4+)

Systemtic Name: (Z)-4-oxidanylidenepent-2-en-2-olate; propane-1,3-diolate; titanium(4+) Openeye Name: (Z)-4-oxopent-2-en-2-olate; propane-1,3-diolate; titanium(4+) CAS Name: (Z)-4-oxo-2-penten-2-olate; propane-1,3-diolate; titanium(4+) IUPAC Name: (Z)-4-oxopent-2-en-2-olate; propane-1,3-diolate; titanium(4+) Traditional Name: (Z)-4-ketopent-2-en-2-olate; propane-1,3-diolate; titanium(4+) Formula: C13H20O6Ti MolecularWeight: 320.1613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].C(C[O-])C[O-].[Ti+4]

Isomeric SMILES

C/C(=C/C(=O)C)/[O-].C/C(=C/C(=O)C)/[O-].C(C[O-])C[O-].[Ti+4]

InChI

InChI=1S/2C5H8O2.C3H6O2.Ti/c2*1-4(6)3-5(2)7;4-2-1-3-5;/h2*3,6H,1-2H3;1-3H2;/q;;-2;+4/p-2/b2*4-3-;;