dimethylazanide; 1H-inden-1-ide; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; titanium(4+)

Systemtic Name: dimethylazanide; 1H-inden-1-ide; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; titanium(4+) Openeye Name: dimethylazanide; 1H-inden-1-ide; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; titanium(4+) CAS Name: dimethylazanide; 1H-inden-1-ide; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; titanium(4+) IUPAC Name: dimethylazanide; 1H-inden-1-ide; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; titanium(4+) Traditional Name: dimethylazanide; 1H-inden-1-ide; [(1E,3E)-4-phenylbuta-1,3-dienyl]benzene; titanium(4+) Formula: C31H39N3Ti MolecularWeight: 501.52846

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Descriptors Computed from Structure

Canonical SMILES:

C[N-]C.C[N-]C.C[N-]C.[CH-]1C=CC2=CC=CC=C21.C1=CC=C(C=C1)C=CC=CC2=CC=CC=C2.[Ti+4]

Isomeric SMILES

C[N-]C.C[N-]C.C[N-]C.[CH-]1C2=CC=CC=C2C=C1.C1=CC=C(C=C1)/C=C/C=C/C2=CC=CC=C2.[Ti+4]

InChI

InChI=1S/C16H14.C9H7.3C2H6N.Ti/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16;1-2-5-9-7-3-6-8(9)4-1;3*1-3-2;/h1-14H;1-7H;3*1-2H3;/q;4*-1;+4/b13-7+,14-8+;;;;;