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methane; methanolate; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+)

methane; methanolate; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+)

Systemtic Name:methane; methanolate; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+)
Openeye Name:methane; methanolate; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+)
CAS Name:methane; methanolate; 4-(3-methyl-1-cyclopenta-1,3-dienyl)-2-phenylphenol; titanium(2+)
IUPAC Name:methane; methanolate; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenylphenol; titanium(2+)
Traditional Name:methane; methanolate; 4-(3-methylcyclopenta-1,3-dien-1-yl)-2-phenyl-phenol; titanium(2+)
Formula: C21H26O3Ti
MolecularWeight: 374.29634
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Descriptors Computed from Structure

Canonical SMILES:

C.CC1=CCC(=C1)C2=CC(=C(C=C2)O)C3=CC=CC=C3.C[O-].C[O-].[Ti+2]


Isomeric SMILES

C.CC1=CCC(=C1)C2=CC(=C(C=C2)O)C3=CC=CC=C3.C[O-].C[O-].[Ti+2]


InChI

InChI=1S/C18H16O.2CH3O.CH4.Ti/c1-13-7-8-15(11-13)16-9-10-18(19)17(12-16)14-5-3-2-4-6-14;2*1-2;;/h2-7,9-12,19H,8H2,1H3;2*1H3;1H4;/q;2*-1;;+2


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