carbanide; cyclododecylcarbonylazanide; 2-methyl-1H-s-indacen-1-ide; titanium(4+)

Systemtic Name: carbanide; cyclododecylcarbonylazanide; 2-methyl-1H-s-indacen-1-ide; titanium(4+) Openeye Name: carbanide; cyclododecanecarbonylazanide; 2-methyl-1H-s-indacen-1-ide; titanium(4+) CAS Name: carbanide; [cyclododecyl(oxo)methyl]azanide; 2-methyl-1H-s-indacen-1-ide; titanium(4+) IUPAC Name: carbanide; cyclododecanecarbonylazanide; 2-methyl-1H-s-indacen-1-ide; titanium(4+) Traditional Name: carbanide; cyclododecanecarbonylazanide; 2-methyl-1H-s-indacen-1-ide; titanium(4+) Formula: C28H39NOTi MolecularWeight: 453.48236

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CC1=CC2=CC3=CC=CC3=CC2=[C-]1.C1CCCCCC(CCCCC1)C(=O)[NH-].[Ti+4]

Isomeric SMILES

[CH3-].[CH3-].CC1=CC2=CC3=CC=CC3=CC2=[C-]1.C1CCCCCC(CCCCC1)C(=O)[NH-].[Ti+4]

InChI

InChI=1S/C13H25NO.C13H9.2CH3.Ti/c14-13(15)12-10-8-6-4-2-1-3-5-7-9-11-12;1-9-5-12-7-10-3-2-4-11(10)8-13(12)6-9;;;/h12H,1-11H2,(H2,14,15);2-5,7-8H,1H3;2*1H3;/q;3*-1;+4/p-1