carbanide; cyclopenta-1,3-diene; methane; phenol; titanium(3+); diphenoxide

Systemtic Name: carbanide; cyclopenta-1,3-diene; methane; phenol; titanium(3+); diphenoxide Openeye Name: carbanide; cyclopenta-1,3-diene; methane; phenol; titanium(3+); diphenoxide CAS Name: carbanide; cyclopenta-1,3-diene; methane; phenol; titanium(3+); diphenoxide IUPAC Name: carbanide; cyclopenta-1,3-diene; methane; phenol; titanium(3+); diphenoxide Traditional Name: carbanide; cyclopenta-1,3-diene; methane; phenol; titanium(3+); diphenoxide Formula: C26H31O3Ti-2 MolecularWeight: 439.38954

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Descriptors Computed from Structure

Canonical SMILES:

C.[CH3-].[CH3-].[CH-]1C=CC=C1.C1=CC=C(C=C1)O.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ti+3]

Isomeric SMILES

C.[CH3-].[CH3-].[CH-]1C=CC=C1.C1=CC=C(C=C1)O.C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ti+3]

InChI

InChI=1S/3C6H6O.C5H5.CH4.2CH3.Ti/c3*7-6-4-2-1-3-5-6;1-2-4-5-3-1;;;;/h3*1-5,7H;1-5H;1H4;2*1H3;/q;;;-1;;2*-1;+3/p-2