methyl 2-(1,3-dimethyl-1,4-dihydroinden-4-id-2-yl)ethanoate; titanium(4+); trichloride

Systemtic Name: methyl 2-(1,3-dimethyl-1,4-dihydroinden-4-id-2-yl)ethanoate; titanium(4+); trichloride Openeye Name: methyl 2-(1,3-dimethyl-1,4-dihydroinden-4-id-2-yl)acetate; titanium(4+); trichloride CAS Name: 2-(1,3-dimethyl-1,4-dihydroinden-4-id-2-yl)acetic acid methyl ester; titanium(4+); trichloride IUPAC Name: methyl 2-(1,3-dimethyl-1,4-dihydroinden-4-id-2-yl)acetate; titanium(4+); trichloride Traditional Name: 2-(1,3-dimethyl-1,4-dihydroinden-4-id-2-yl)acetic acid methyl ester; titanium(4+); trichloride Formula: C14H15Cl3O2Ti MolecularWeight: 369.4937

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C([C-]=CC=C2)C(=C1CC(=O)OC)C.[Cl-].[Cl-].[Cl-].[Ti+4]

Isomeric SMILES

CC1C2=C([C-]=CC=C2)C(=C1CC(=O)OC)C.[Cl-].[Cl-].[Cl-].[Ti+4]

InChI

InChI=1S/C14H15O2.3ClH.Ti/c1-9-11-6-4-5-7-12(11)10(2)13(9)8-14(15)16-3;;;;/h4-6,9H,8H2,1-3H3;3*1H;/q-1;;;;+4/p-3