N,N-dimethyl-1-(2-phenylcyclopenta-1,4-dien-1-yl)methanamine; dioxidanylmethylbenzene; titanium; dichloride

Systemtic Name: N,N-dimethyl-1-(2-phenylcyclopenta-1,4-dien-1-yl)methanamine; dioxidanylmethylbenzene; titanium; dichloride Openeye Name: N,N-dimethyl-1-(2-phenylcyclopenta-1,4-dien-1-yl)methanamine; hydroperoxymethylbenzene; titanium; dichloride CAS Name: N,N-dimethyl-1-(2-phenyl-1-cyclopenta-1,4-dienyl)methanamine; hydroperoxymethylbenzene; titanium; dichloride IUPAC Name: N,N-dimethyl-1-(2-phenylcyclopenta-1,4-dien-1-yl)methanamine; hydroperoxymethylbenzene; titanium; dichloride Traditional Name: dimethyl-[(2-phenylcyclopenta-1,4-dien-1-yl)methyl]amine; hydroperoxymethylbenzene; titanium; dichloride Formula: C21H24Cl2NO2Ti-3 MolecularWeight: 441.19376

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(CC=C1)C2=CC=CC=[C-]2.C1=CC=C(C=C1)COO.[Cl-].[Cl-].[Ti]

Isomeric SMILES

CN(C)CC1=C(CC=C1)C2=CC=CC=[C-]2.C1=CC=C(C=C1)COO.[Cl-].[Cl-].[Ti]

InChI

InChI=1S/C14H16N.C7H8O2.2ClH.Ti/c1-15(2)11-13-9-6-10-14(13)12-7-4-3-5-8-12;8-9-6-7-4-2-1-3-5-7;;;/h3-7,9H,10-11H2,1-2H3;1-5,8H,6H2;2*1H;/q-1;;;;/p-2