butylazanide; (3-methylcyclopenta-1,3-dien-1-yl)benzene; propane; titanium(3+); dichloride

Systemtic Name: butylazanide; (3-methylcyclopenta-1,3-dien-1-yl)benzene; propane; titanium(3+); dichloride Openeye Name: butylazanide; (3-methylcyclopenta-1,3-dien-1-yl)benzene; propane; titanium(3+); dichloride CAS Name: butylazanide; (3-methyl-1-cyclopenta-1,3-dienyl)benzene; propane; titanium(3+); dichloride IUPAC Name: butylazanide; (3-methylcyclopenta-1,3-dien-1-yl)benzene; propane; titanium(3+); dichloride Traditional Name: butylazanide; (3-methylcyclopenta-1,3-dien-1-yl)benzene; propane; titanium(3+); dichloride Formula: C19H28Cl2NTi-2 MolecularWeight: 389.20532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH-].C[CH-]C.CC1=CCC(=C1)C2=CC=CC=[C-]2.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CCCC[NH-].C[CH-]C.CC1=CCC(=C1)C2=CC=CC=[C-]2.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C12H11.C4H10N.C3H7.2ClH.Ti/c1-10-7-8-12(9-10)11-5-3-2-4-6-11;1-2-3-4-5;1-3-2;;;/h2-5,7,9H,8H2,1H3;5H,2-4H2,1H3;3H,1-2H3;2*1H;/q3*-1;;;+3/p-2