methyl-(7-methyliminocyclohepta-1,3,5-trien-1-yl)azanide; 2-methyl-4-phenyl-but-3-en-2-ol; titanium(3+)

Systemtic Name: methyl-(7-methyliminocyclohepta-1,3,5-trien-1-yl)azanide; 2-methyl-4-phenyl-but-3-en-2-ol; titanium(3+) Openeye Name: methyl-(7-methyliminocyclohepta-1,3,5-trien-1-yl)azanide; 2-methyl-4-phenyl-but-3-en-2-ol; titanium(3+) CAS Name: methyl-(7-methylimino-1-cyclohepta-1,3,5-trienyl)azanide; 2-methyl-4-phenyl-3-buten-2-ol; titanium(3+) IUPAC Name: methyl-(7-methyliminocyclohepta-1,3,5-trien-1-yl)azanide; 2-methyl-4-phenylbut-3-en-2-ol; titanium(3+) Traditional Name: methyl-(7-methyliminocyclohepta-1,3,5-trien-1-yl)azanide; 2-methyl-4-phenyl-but-3-en-2-ol; titanium(3+) Formula: C29H35N4OTi MolecularWeight: 503.4814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=[C-]C1=CC=CC=C1)O.C[N-]C1=CC=CC=CC1=NC.C[N-]C1=CC=CC=CC1=NC.[Ti+3]

Isomeric SMILES

CC(C)(C=[C-]C1=CC=CC=C1)O.C[N-]C1=CC=CC=CC1=NC.C[N-]C1=CC=CC=CC1=NC.[Ti+3]

InChI

InChI=1S/C11H13O.2C9H11N2.Ti/c1-11(2,12)9-8-10-6-4-3-5-7-10;2*1-10-8-6-4-3-5-7-9(8)11-2;/h3-7,9,12H,1-2H3;2*3-7H,1-2H3;/q3*-1;+3