1,4-bis(oxidanylidene)naphthalen-2-olate; propan-2-olate; titanium(4+)

Systemtic Name: 1,4-bis(oxidanylidene)naphthalen-2-olate; propan-2-olate; titanium(4+) Openeye Name: 1,4-dioxonaphthalen-2-olate; propan-2-olate; titanium(4+) CAS Name: 1,4-dioxo-2-naphthalenolate; 2-propanolate; titanium(4+) IUPAC Name: 1,4-dioxonaphthalen-2-olate; propan-2-olate; titanium(4+) Traditional Name: 1,4-diketonaphthalen-2-olate; propan-2-olate; titanium(4+) Formula: C26H24O8Ti MolecularWeight: 512.33096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C10H6O3.2C3H7O.Ti/c2*11-8-5-9(12)10(13)7-4-2-1-3-6(7)8;2*1-3(2)4;/h2*1-5,12H;2*3H,1-2H3;/q;;2*-1;+4/p-2