2-ethyl-3-oxidanylidene-butanoic acid; propan-2-olate; titanium(2+)

Systemtic Name: 2-ethyl-3-oxidanylidene-butanoic acid; propan-2-olate; titanium(2+) Openeye Name: 2-ethyl-3-oxo-butanoic acid; propan-2-olate; titanium(2+) CAS Name: 2-ethyl-3-oxobutanoic acid; 2-propanolate; titanium(2+) IUPAC Name: 2-ethyl-3-oxobutanoic acid; propan-2-olate; titanium(2+) Traditional Name: 2-ethyl-3-keto-butyric acid; propan-2-olate; titanium(2+) Formula: C12H24O5Ti MolecularWeight: 296.18296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C)C(=O)O.CC(C)[O-].CC(C)[O-].[Ti+2]

Isomeric SMILES

CCC(C(=O)C)C(=O)O.CC(C)[O-].CC(C)[O-].[Ti+2]

InChI

InChI=1S/C6H10O3.2C3H7O.Ti/c1-3-5(4(2)7)6(8)9;2*1-3(2)4;/h5H,3H2,1-2H3,(H,8,9);2*3H,1-2H3;/q;2*-1;+2