chloranyltitanium(3+); cyclopentane; (4-iodophenyl)methanone

Systemtic Name: chloranyltitanium(3+); cyclopentane; (4-iodophenyl)methanone Openeye Name: chlorotitanium(3+); cyclopentane; (4-iodophenyl)methanone CAS Name: chlorotitanium(3+); cyclopentane; (4-iodophenyl)methanone IUPAC Name: chlorotitanium(3+); cyclopentane; (4-iodophenyl)methanone Traditional Name: chlorotitanium(3+); cyclopentane; (4-iodophenyl)methanone Formula: C17H14ClIOTi+2 MolecularWeight: 444.51693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[C-]=O)I.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.Cl[Ti+3]

Isomeric SMILES

C1=CC(=CC=C1[C-]=O)I.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.Cl[Ti+3]

InChI

InChI=1S/C7H4IO.2C5H5.ClH.Ti/c8-7-3-1-6(5-9)2-4-7;2*1-2-4-5-3-1;;/h1-4H;2*1-5H;1H;/q-1;;;;+4/p-1