propanoylazanide; titanium(4+); hexachloride

Systemtic Name: propanoylazanide; titanium(4+); hexachloride Openeye Name: propanoylazanide; titanium(4+); hexachloride CAS Name: 1-oxopropylazanide; titanium(4+); hexachloride IUPAC Name: propanoylazanide; titanium(4+); hexachloride Traditional Name: propionylazanide; titanium(4+); hexachloride Formula: C18H36Cl6N6O6Ti3 MolecularWeight: 788.83404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4].[Ti+4].[Ti+4]

Isomeric SMILES

CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].CCC(=O)[NH-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4].[Ti+4].[Ti+4]

InChI

InChI=1S/6C3H7NO.6ClH.3Ti/c6*1-2-3(4)5;;;;;;;;;/h6*2H2,1H3,(H2,4,5);6*1H;;;/q;;;;;;;;;;;;3*+4/p-12