1H-inden-1-ide; 2-methylpropanoylazanide; 4-oxidanylbutan-2-ylidenetitanium(2+); dichloride

Systemtic Name: 1H-inden-1-ide; 2-methylpropanoylazanide; 4-oxidanylbutan-2-ylidenetitanium(2+); dichloride Openeye Name: (3-hydroxy-1-methyl-propylidene)titanium(2+); 1H-inden-1-ide; 2-methylpropanoylazanide; dichloride CAS Name: 4-hydroxybutan-2-ylidenetitanium(2+); 1H-inden-1-ide; (2-methyl-1-oxopropyl)azanide; dichloride IUPAC Name: 4-hydroxybutan-2-ylidenetitanium(2+); 1H-inden-1-ide; 2-methylpropanoylazanide; dichloride Traditional Name: (3-hydroxy-1-methyl-propylidene)titanium(2+); 1H-inden-1-ide; isobutyrylazanide; dichloride Formula: C17H23Cl2NO2Ti-2 MolecularWeight: 392.14302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)[NH-].CC(=[Ti+2])CCO.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-]

Isomeric SMILES

CC(C)C(=O)[NH-].CC(=[Ti+2])CCO.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-]

InChI

InChI=1S/C9H7.C4H9NO.C4H8O.2ClH.Ti/c1-2-5-9-7-3-6-8(9)4-1;1-3(2)4(5)6;1-2-3-4-5;;;/h1-7H;3H,1-2H3,(H2,5,6);5H,3-4H2,1H3;2*1H;/q-1;;;;;+2/p-3