1,2-diethyl-3-pentan-3-yl-benzene; titanium(4+)

Systemtic Name: 1,2-diethyl-3-pentan-3-yl-benzene; titanium(4+) Openeye Name: 1,2-diethyl-3-(1-ethylpropyl)benzene; titanium(4+) CAS Name: 1,2-diethyl-3-pentan-3-ylbenzene; titanium(4+) IUPAC Name: 1,2-diethyl-3-pentan-3-ylbenzene; titanium(4+) Traditional Name: 1,2-diethyl-3-(1-ethylpropyl)benzene; titanium(4+) Formula: C60H92Ti MolecularWeight: 861.23948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1CC)[C-](CC)CC.CCC1=CC=CC(=C1CC)[C-](CC)CC.CCC1=CC=CC(=C1CC)[C-](CC)CC.CCC1=CC=CC(=C1CC)[C-](CC)CC.[Ti+4]

Isomeric SMILES

CCC1=CC=CC(=C1CC)[C-](CC)CC.CCC1=CC=CC(=C1CC)[C-](CC)CC.CCC1=CC=CC(=C1CC)[C-](CC)CC.CCC1=CC=CC(=C1CC)[C-](CC)CC.[Ti+4]

InChI

InChI=1S/4C15H23.Ti/c4*1-5-12(6-2)15-11-9-10-13(7-3)14(15)8-4;/h4*9-11H,5-8H2,1-4H3;/q4*-1;+4