methyl 4,4-dimethyl-3-oxidanylidene-pentanoate; oxidanylidenetitanium; propan-2-one

Systemtic Name: methyl 4,4-dimethyl-3-oxidanylidene-pentanoate; oxidanylidenetitanium; propan-2-one Openeye Name: acetone; methyl 4,4-dimethyl-3-oxo-pentanoate; oxotitanium CAS Name: 4,4-dimethyl-3-oxopentanoic acid methyl ester; oxotitanium; 2-propanone IUPAC Name: methyl 4,4-dimethyl-3-oxopentanoate; oxotitanium; propan-2-one Traditional Name: acetone; 3-keto-4,4-dimethyl-valeric acid methyl ester; ketotitanium Formula: C19H34O8Ti MolecularWeight: 438.33546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C8H14O3.C3H6O.O.Ti/c2*1-8(2,3)6(9)5-7(10)11-4;1-3(2)4;;/h2*5H2,1-4H3;1-2H3;;