carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+); dichloride

Systemtic Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+); dichloride Openeye Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+); dichloride CAS Name: carbanide; methane; 4-(3-methyl-1-cyclopenta-1,3-dienyl)-2-phenylphenol; titanium(2+); dichloride IUPAC Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenylphenol; titanium(2+); dichloride Traditional Name: carbanide; methane; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+); dichloride Formula: C21H26Cl2OTi-2 MolecularWeight: 413.20354

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Descriptors Computed from Structure

Canonical SMILES:

C.[CH3-].[CH3-].CC1=CCC(=C1)C2=CC(=C(C=C2)O)C3=CC=CC=C3.[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

C.[CH3-].[CH3-].CC1=CCC(=C1)C2=CC(=C(C=C2)O)C3=CC=CC=C3.[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C18H16O.CH4.2CH3.2ClH.Ti/c1-13-7-8-15(11-13)16-9-10-18(19)17(12-16)14-5-3-2-4-6-14;;;;;;/h2-7,9-12,19H,8H2,1H3;1H4;2*1H3;2*1H;/q;;2*-1;;;+2/p-2