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

Systemtic Name: bis(oxidanidyl)-oxidanylidene-titanium; 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; propane Openeye Name: dioxido(oxo)titanium; 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; propane CAS Name: dioxido(oxo)titanium; 16-methyl-1-heptadecanone; 2-methyl-2-propen-1-one; propane IUPAC Name: dioxido(oxo)titanium; 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; propane Traditional Name: keto(dioxido)titanium; 16-methylheptadecan-1-one; 2-methylprop-2-en-1-one; n-propane Formula: C29H53O6Ti-5 MolecularWeight: 545.59452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H35O.2C4H5O.C3H8.3O.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;3H2,1-2H3;;;;/q3*-1;;;2*-1;