1-methanidyl-4-propan-2-yl-benzene; titanium(4+)

Systemtic Name: 1-methanidyl-4-propan-2-yl-benzene; titanium(4+) Openeye Name: 1-isopropyl-4-methanidyl-benzene; titanium(4+) CAS Name: 1-methanidyl-4-propan-2-ylbenzene; titanium(4+) IUPAC Name: 1-methanidyl-4-propan-2-ylbenzene; titanium(4+) Traditional Name: 1-isopropyl-4-methanidyl-benzene; titanium(4+) Formula: C40H52Ti MolecularWeight: 580.70788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[CH2-].CC(C)C1=CC=C(C=C1)[CH2-].CC(C)C1=CC=C(C=C1)[CH2-].CC(C)C1=CC=C(C=C1)[CH2-].[Ti+4]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[CH2-].CC(C)C1=CC=C(C=C1)[CH2-].CC(C)C1=CC=C(C=C1)[CH2-].CC(C)C1=CC=C(C=C1)[CH2-].[Ti+4]

InChI

InChI=1S/4C10H13.Ti/c4*1-8(2)10-6-4-9(3)5-7-10;/h4*4-8H,3H2,1-2H3;/q4*-1;+4