phenylmethanol; titanium; (2,3,4-trimethylcyclopenta-1,3-dien-1-yl)benzene; dichloride

Systemtic Name: phenylmethanol; titanium; (2,3,4-trimethylcyclopenta-1,3-dien-1-yl)benzene; dichloride Openeye Name: phenylmethanol; titanium; (2,3,4-trimethylcyclopenta-1,3-dien-1-yl)benzene; dichloride CAS Name: phenylmethanol; titanium; (2,3,4-trimethyl-1-cyclopenta-1,3-dienyl)benzene; dichloride IUPAC Name: phenylmethanol; titanium; (2,3,4-trimethylcyclopenta-1,3-dien-1-yl)benzene; dichloride Traditional Name: phenylmethanol; titanium; (2,3,4-trimethylcyclopenta-1,3-dien-1-yl)benzene; dichloride Formula: C21H23Cl2OTi-3 MolecularWeight: 410.17972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15.C7H8O.2ClH.Ti/c1-10-9-14(12(3)11(10)2)13-7-5-4-6-8-13;8-6-7-4-2-1-3-5-7;;;/h4-7H,9H2,1-3H3;1-5,8H,6H2;2*1H;/q-1;;;;/p-2