cyclopentane; 1,1-diphenylhexa-1,5-dien-2-ol; titanium(3+)

Systemtic Name: cyclopentane; 1,1-diphenylhexa-1,5-dien-2-ol; titanium(3+) Openeye Name: cyclopentane; 1,1-diphenylhexa-1,5-dien-2-ol; titanium(3+) CAS Name: cyclopentane; 1,1-diphenyl-2-hexa-1,5-dienol; titanium(3+) IUPAC Name: cyclopentane; 1,1-diphenylhexa-1,5-dien-2-ol; titanium(3+) Traditional Name: cyclopentane; 1,1-diphenylhexa-1,5-dien-2-ol; titanium(3+) Formula: C28H27OTi+2 MolecularWeight: 427.38038

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Descriptors Computed from Structure

Canonical SMILES:

C=[C-]CCC(=C(C1=CC=CC=C1)C2=CC=CC=C2)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+3]

Isomeric SMILES

C=[C-]CCC(=C(C1=CC=CC=C1)C2=CC=CC=C2)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+3]

InChI

InChI=1S/C18H17O.2C5H5.Ti/c1-2-3-14-17(19)18(15-10-6-4-7-11-15)16-12-8-5-9-13-16;2*1-2-4-5-3-1;/h4-13,19H,1,3,14H2;2*1-5H;/q-1;;;+3