cyclopenta-1,3-diene; 2-methyl-3,4-diphenyl-but-3-en-2-ol; titanium

Systemtic Name: cyclopenta-1,3-diene; 2-methyl-3,4-diphenyl-but-3-en-2-ol; titanium Openeye Name: cyclopenta-1,3-diene; 2-methyl-3,4-diphenyl-but-3-en-2-ol; titanium CAS Name: cyclopenta-1,3-diene; 2-methyl-3,4-diphenyl-3-buten-2-ol; titanium IUPAC Name: cyclopenta-1,3-diene; 2-methyl-3,4-diphenylbut-3-en-2-ol; titanium Traditional Name: cyclopenta-1,3-diene; 2-methyl-3,4-diphenyl-but-3-en-2-ol; titanium Formula: C27H27OTi-3 MolecularWeight: 415.36968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=[C-]C1=CC=CC=C1)C2=CC=CC=C2)O.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti]

Isomeric SMILES

CC(C)(C(=[C-]C1=CC=CC=C1)C2=CC=CC=C2)O.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ti]

InChI

InChI=1S/C17H17O.2C5H5.Ti/c1-17(2,18)16(15-11-7-4-8-12-15)13-14-9-5-3-6-10-14;2*1-2-4-5-3-1;/h3-12,18H,1-2H3;2*1-5H;/q3*-1;