4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); diphenoxide

Systemtic Name: 4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); diphenoxide Openeye Name: 4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); diphenoxide CAS Name: 4-(3-tert-butyl-1-cyclopenta-1,3-dienyl)phenol; carbanide; methane; titanium(2+); diphenoxide IUPAC Name: 4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); diphenoxide Traditional Name: 4-(3-tert-butylcyclopenta-1,3-dien-1-yl)phenol; carbanide; methane; titanium(2+); diphenoxide Formula: C30H38O3Ti-2 MolecularWeight: 494.48792

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Descriptors Computed from Structure

Canonical SMILES:

C.[CH3-].[CH3-].CC(C)(C)C1=CCC(=C1)C2=CC=C(C=C2)O.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ti+2]

Isomeric SMILES

C.[CH3-].[CH3-].CC(C)(C)C1=CCC(=C1)C2=CC=C(C=C2)O.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ti+2]

InChI

InChI=1S/C15H18O.2C6H6O.CH4.2CH3.Ti/c1-15(2,3)13-7-4-12(10-13)11-5-8-14(16)9-6-11;2*7-6-4-2-1-3-5-6;;;;/h5-10,16H,4H2,1-3H3;2*1-5,7H;1H4;2*1H3;/q;;;;2*-1;+2/p-2