butylazanide; 1-methanidyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; titanium(2+); dichloride

Systemtic Name: butylazanide; 1-methanidyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; titanium(2+); dichloride Openeye Name: butylazanide; 1-methanidyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; titanium(2+); dichloride CAS Name: butylazanide; 1-methanidyl-2-(3-methyl-1-cyclopenta-1,3-dienyl)benzene; titanium(2+); dichloride IUPAC Name: butylazanide; 1-methanidyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; titanium(2+); dichloride Traditional Name: butylazanide; 1-methanidyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; titanium(2+); dichloride Formula: C17H23Cl2NTi-2 MolecularWeight: 360.14422

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH-].CC1=CCC(=C1)C2=CC=CC=C2[CH2-].[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

CCCC[NH-].CC1=CCC(=C1)C2=CC=CC=C2[CH2-].[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C13H13.C4H10N.2ClH.Ti/c1-10-7-8-12(9-10)13-6-4-3-5-11(13)2;1-2-3-4-5;;;/h3-7,9H,2,8H2,1H3;5H,2-4H2,1H3;2*1H;/q2*-1;;;+2/p-2