ethanolate; 3-oxidanylidene-2-phenyl-inden-1-olate; titanium

Systemtic Name: ethanolate; 3-oxidanylidene-2-phenyl-inden-1-olate; titanium Openeye Name: ethanolate; 3-oxo-2-phenyl-inden-1-olate; titanium CAS Name: ethanolate; 3-oxo-2-phenyl-1-indenolate; titanium IUPAC Name: ethanolate; 3-oxo-2-phenylinden-1-olate; titanium Traditional Name: ethanolate; 3-keto-2-phenyl-inden-1-olate; titanium Formula: C34H28O6Ti-4 MolecularWeight: 580.44952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[O-].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[O-].[Ti]

Isomeric SMILES

CC[O-].CC[O-].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[O-].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[O-].[Ti]

InChI

InChI=1S/2C15H10O2.2C2H5O.Ti/c2*16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10;2*1-2-3;/h2*1-9,16H;2*2H2,1H3;/q;;2*-1;/p-2