16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; oxidanidyl(oxidanylidene)titanium; propane; hydroxide

Systemtic Name: 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; oxidanidyl(oxidanylidene)titanium; propane; hydroxide Openeye Name: 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; oxido(oxo)titanium; propane; hydroxide CAS Name: 16-methyl-1-heptadecanone; 2-methyl-2-propen-1-one; oxido(oxo)titanium; propane; hydroxide IUPAC Name: 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; oxido(oxo)titanium; propane; hydroxide Traditional Name: keto(oxido)titanium; 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; propane; hydroxide Formula: C29H53O6Ti-6 MolecularWeight: 545.59452

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Descriptors Computed from Structure

Canonical SMILES:

C[CH-]C.CC(C)CCCCCCCCCCCCCC[C-]=O.CC(=C)[C-]=O.CC(=C)[C-]=O.[OH-].[O-][Ti]=O

Isomeric SMILES

C[CH-]C.CC(C)CCCCCCCCCCCCCC[C-]=O.CC(=C)[C-]=O.CC(=C)[C-]=O.[OH-].[O-][Ti]=O

InChI

InChI=1S/C18H35O.2C4H5O.C3H7.H2O.2O.Ti/c1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19;2*1-4(2)3-5;1-3-2;;;;/h18H,3-16H2,1-2H3;2*1H2,2H3;3H,1-2H3;1H2;;;/q4*-1;;;-1;/p-1