3,4-bis(oxidanylidene)naphthalen-1-olate; ethanolate; titanium(4+)

Systemtic Name: 3,4-bis(oxidanylidene)naphthalen-1-olate; ethanolate; titanium(4+) Openeye Name: 3,4-dioxonaphthalen-1-olate; ethanolate; titanium(4+) CAS Name: 3,4-dioxo-1-naphthalenolate; ethanolate; titanium(4+) IUPAC Name: 3,4-dioxonaphthalen-1-olate; ethanolate; titanium(4+) Traditional Name: 3,4-diketonaphthalen-1-olate; ethanolate; titanium(4+) Formula: C24H20O8Ti MolecularWeight: 484.2778

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Descriptors Computed from Structure

Canonical SMILES:

CC[O-].CC[O-].C1=CC=C2C(=C1)C(=CC(=O)C2=O)[O-].C1=CC=C2C(=C1)C(=CC(=O)C2=O)[O-].[Ti+4]

Isomeric SMILES

CC[O-].CC[O-].C1=CC=C2C(=C1)C(=CC(=O)C2=O)[O-].C1=CC=C2C(=C1)C(=CC(=O)C2=O)[O-].[Ti+4]

InChI

InChI=1S/2C10H6O3.2C2H5O.Ti/c2*11-8-5-9(12)10(13)7-4-2-1-3-6(7)8;2*1-2-3;/h2*1-5,11H;2*2H2,1H3;/q;;2*-1;+4/p-2