4-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-2-olate; thallium(1+)

Systemtic Name: 4-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-2-olate; thallium(1+) Openeye Name: 4-oxo-3-(3-oxo-1-phenyl-butyl)chromen-2-olate; thallium(1+) CAS Name: 4-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-2-olate; thallium(1+) IUPAC Name: 4-oxo-3-(3-oxo-1-phenylbutyl)chromen-2-olate; thallium(1+) Traditional Name: 4-keto-3-(3-keto-1-phenyl-butyl)chromen-2-olate; thallium(1+) Formula: C19H15O4Tl MolecularWeight: 511.7033

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)[O-].[Tl+]

Isomeric SMILES

CC(=O)CC(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)[O-].[Tl+]

InChI

InChI=1S/C19H16O4.Tl/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;/h2-10,15,22H,11H2,1H3;/q;+1/p-1