ethanolate; 4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-olate; titanium(4+)

Systemtic Name: ethanolate; 4-oxidanyl-9,10-bis(oxidanylidene)anthracen-1-olate; titanium(4+) Openeye Name: ethanolate; 4-hydroxy-9,10-dioxo-anthracen-1-olate; titanium(4+) CAS Name: ethanolate; 4-hydroxy-9,10-dioxo-1-anthracenolate; titanium(4+) IUPAC Name: ethanolate; 4-hydroxy-9,10-dioxoanthracen-1-olate; titanium(4+) Traditional Name: ethanolate; 4-hydroxy-9,10-diketo-anthracen-1-olate; titanium(4+) Formula: C32H24O10Ti MolecularWeight: 616.39396

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[O-])O.C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[O-])O.[Ti+4]

Isomeric SMILES

CC[O-].CC[O-].C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[O-])O.C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)[O-])O.[Ti+4]

InChI

InChI=1S/2C14H8O4.2C2H5O.Ti/c2*15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18;2*1-2-3;/h2*1-6,15-16H;2*2H2,1H3;/q;;2*-1;+4/p-2