chloranyltitanium(1+); cyclopentane; oct-3-yne

Systemtic Name: chloranyltitanium(1+); cyclopentane; oct-3-yne Openeye Name: chlorotitanium(1+); cyclopentane; oct-3-yne CAS Name: chlorotitanium(1+); cyclopentane; 3-octyne IUPAC Name: chlorotitanium(1+); cyclopentane; oct-3-yne Traditional Name: chlorotitanium(1+); cyclopentane; oct-3-yne Formula: C18H23ClTi MolecularWeight: 322.69522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC#CCCC[CH2-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.Cl[Ti+]

Isomeric SMILES

CCC#CCCC[CH2-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.Cl[Ti+]

InChI

InChI=1S/C8H13.2C5H5.ClH.Ti/c1-3-5-7-8-6-4-2;2*1-2-4-5-3-1;;/h1,3-5,7H2,2H3;2*1-5H;1H;/q-1;;;;+2/p-1