chloranyltitanium(3+); [(Z)-4-cyclohexyl-2-methyl-but-2-enyl]benzene; cyclopentane

Systemtic Name: chloranyltitanium(3+); [(Z)-4-cyclohexyl-2-methyl-but-2-enyl]benzene; cyclopentane Openeye Name: chlorotitanium(3+); [(Z)-4-cyclohexyl-2-methyl-but-2-enyl]benzene; cyclopentane CAS Name: chlorotitanium(3+); [(Z)-4-cyclohexyl-2-methylbut-2-enyl]benzene; cyclopentane IUPAC Name: chlorotitanium(3+); [(Z)-4-cyclohexyl-2-methylbut-2-enyl]benzene; cyclopentane Traditional Name: chlorotitanium(3+); [(Z)-4-cyclohexyl-2-methyl-but-2-enyl]benzene; cyclopentane Formula: C22H27ClTi+ MolecularWeight: 374.76978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C[CH-]C1CCCCC1)[CH-]C2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.Cl[Ti+3]

Isomeric SMILES

C/C(=C/[CH-]C1CCCCC1)/[CH-]C2=CC=CC=C2.[CH]1[CH][CH][CH][CH]1.Cl[Ti+3]

InChI

InChI=1S/C17H22.C5H5.ClH.Ti/c1-15(14-17-10-6-3-7-11-17)12-13-16-8-4-2-5-9-16;1-2-4-5-3-1;;/h3,6-7,10-14,16H,2,4-5,8-9H2,1H3;1-5H;1H;/q-2;;;+4/p-1/b15-12-;;;