2-oxidanylidene-2-phenyl-ethanoic acid; propan-2-ol; titanium

Systemtic Name: 2-oxidanylidene-2-phenyl-ethanoic acid; propan-2-ol; titanium Openeye Name: 2-oxo-2-phenyl-acetic acid; propan-2-ol; titanium CAS Name: 2-oxo-2-phenylacetic acid; 2-propanol; titanium IUPAC Name: 2-oxo-2-phenylacetic acid; propan-2-ol; titanium Traditional Name: 2-keto-2-phenyl-acetic acid; propan-2-ol; titanium Formula: C17H30O6Ti MolecularWeight: 378.2835

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)O.CC(C)O.CC(C)O.C1=CC=C(C=C1)C(=O)C(=O)O.[Ti]

Isomeric SMILES

CC(C)O.CC(C)O.CC(C)O.C1=CC=C(C=C1)C(=O)C(=O)O.[Ti]

InChI

InChI=1S/C8H6O3.3C3H8O.Ti/c9-7(8(10)11)6-4-2-1-3-5-6;3*1-3(2)4;/h1-5H,(H,10,11);3*3-4H,1-2H3;