ethanone; oxidanylidenetitanium; propan-2-ol; propan-2-one

Systemtic Name: ethanone; oxidanylidenetitanium; propan-2-ol; propan-2-one Openeye Name: ethanone; oxotitanium; propan-2-ol; propan-2-one CAS Name: ethanone; oxotitanium; 2-propanol; 2-propanone IUPAC Name: ethanone; oxotitanium; propan-2-ol; propan-2-one Traditional Name: acetone; ethanone; ketotitanium; propan-2-ol Formula: C13H27O6Ti-3 MolecularWeight: 327.21688

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]=O.C[C-]=O.CC(C)O.CC(C)O.CC(=O)[CH2-].O=[Ti]

Isomeric SMILES

C[C-]=O.C[C-]=O.CC(C)O.CC(C)O.CC(=O)[CH2-].O=[Ti]

InChI

InChI=1S/2C3H8O.C3H5O.2C2H3O.O.Ti/c3*1-3(2)4;2*1-2-3;;/h2*3-4H,1-2H3;1H2,2H3;2*1H3;;/q;;3*-1;;