cyclopenta-1,3-diene; 2,2-dimethylpropanoic acid; 9H-fluoren-9-ide; methylidenetitanium

Systemtic Name: cyclopenta-1,3-diene; 2,2-dimethylpropanoic acid; 9H-fluoren-9-ide; methylidenetitanium Openeye Name: cyclopenta-1,3-diene; 2,2-dimethylpropanoic acid; 9H-fluoren-9-ide; methylenetitanium CAS Name: cyclopenta-1,3-diene; 2,2-dimethylpropanoic acid; 9H-fluoren-9-ide; methylenetitanium IUPAC Name: cyclopenta-1,3-diene; 2,2-dimethylpropanoic acid; 9H-fluoren-9-ide; methylidenetitanium Traditional Name: cyclopenta-1,3-diene; 2,2-dimethylpropionic acid; 9H-fluoren-9-ide; methylenetitanium Formula: C29H36O4Ti-2 MolecularWeight: 496.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.C=[Ti].C1C=CC=[C-]1.[CH-]1C2=CC=CC=C2C3=CC=CC=C31

Isomeric SMILES

CC(C)(C)C(=O)O.CC(C)(C)C(=O)O.C=[Ti].C1C=CC=[C-]1.[CH-]1C2=CC=CC=C2C3=CC=CC=C31

InChI

InChI=1S/C13H9.2C5H10O2.C5H5.CH2.Ti/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;2*1-5(2,3)4(6)7;1-2-4-5-3-1;;/h1-9H;2*1-3H3,(H,6,7);1-3H,4H2;1H2;/q-1;;;-1;;