cyclopentane; (4-methylphenyl)methylideneazanide; titanium(4+); isocyanate

Systemtic Name: cyclopentane; (4-methylphenyl)methylideneazanide; titanium(4+); isocyanate Openeye Name: cyclopentane; p-tolylmethyleneazanide; titanium(4+); isocyanate CAS Name: cyclopentane; (4-methylphenyl)methylideneazanide; titanium(4+); isocyanate IUPAC Name: cyclopentane; (4-methylphenyl)methylideneazanide; titanium(4+); isocyanate Traditional Name: cyclopentane; (4-methylbenzylidene)azanide; titanium(4+); isocyanate Formula: C19H18N2OTi+2 MolecularWeight: 338.22602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=[N-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.C(=[N-])=O.[Ti+4]

Isomeric SMILES

CC1=CC=C(C=C1)C=[N-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.C(=[N-])=O.[Ti+4]

InChI

InChI=1S/C8H8N.2C5H5.CNO.Ti/c1-7-2-4-8(6-9)5-3-7;2*1-2-4-5-3-1;2-1-3;/h2-6H,1H3;2*1-5H;;/q-1;;;-1;+4