ethyloxidanium; (3-oxidanylidene-2-phenyl-inden-1-yl)oxidanium; titanium

Systemtic Name: ethyloxidanium; (3-oxidanylidene-2-phenyl-inden-1-yl)oxidanium; titanium Openeye Name: ethyloxonium; (3-oxo-2-phenyl-inden-1-yl)oxonium; titanium CAS Name: ethyloxonium; (3-oxo-2-phenyl-1-indenyl)oxonium; titanium IUPAC Name: ethyloxidanium; (3-oxo-2-phenylinden-1-yl)oxidanium; titanium Traditional Name: ethyloxonium; (3-keto-2-phenyl-inden-1-yl)oxonium; titanium Formula: C34H36O6Ti+4 MolecularWeight: 588.51304

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Descriptors Computed from Structure

Canonical SMILES:

CC[OH2+].CC[OH2+].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[OH2+].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[OH2+].[Ti]

Isomeric SMILES

CC[OH2+].CC[OH2+].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[OH2+].C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C2=O)[OH2+].[Ti]

InChI

InChI=1S/2C15H10O2.2C2H6O.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*3H,2H2,1H3;/p+4