1-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-2-propoxy-benzene; titanium(3+); dichloride

Systemtic Name: 1-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-2-propoxy-benzene; titanium(3+); dichloride Openeye Name: 1-(1-cyclopenta-1,4-dien-1-yl-1-methyl-ethyl)-2-propoxy-benzene; titanium(3+); dichloride CAS Name: 1-[2-(1-cyclopenta-1,4-dienyl)propan-2-yl]-2-propoxybenzene; titanium(3+); dichloride IUPAC Name: 1-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-2-propoxybenzene; titanium(3+); dichloride Traditional Name: 1-(1-cyclopenta-1,4-dien-1-yl-1-methyl-ethyl)-2-propoxy-benzene; titanium(3+); dichloride Formula: C17H21Cl2OTi MolecularWeight: 360.12104

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(C)(C)C2=[C-]CC=C2.[Cl-].[Cl-].[Ti+3]

Isomeric SMILES

CCCOC1=CC=CC=C1C(C)(C)C2=[C-]CC=C2.[Cl-].[Cl-].[Ti+3]

InChI

InChI=1S/C17H21O.2ClH.Ti/c1-4-13-18-16-12-8-7-11-15(16)17(2,3)14-9-5-6-10-14;;;/h5,7-9,11-12H,4,6,13H2,1-3H3;2*1H;/q-1;;;+3/p-2