diazanium [4-[4,4,4-tris(fluoranyl)-3-oxidanylidene-butyl]phenyl] phosphate

Systemtic Name: diazanium [4-[4,4,4-tris(fluoranyl)-3-oxidanylidene-butyl]phenyl] phosphate Openeye Name: diammonium [4-(4,4,4-trifluoro-3-oxo-butyl)phenyl] phosphate CAS Name: diammonium [4-(4,4,4-trifluoro-3-oxobutyl)phenyl] phosphate IUPAC Name: diazanium [4-(4,4,4-trifluoro-3-oxobutyl)phenyl] phosphate Traditional Name: diammonium [4-(4,4,4-trifluoro-3-keto-butyl)phenyl] phosphate Formula: C10H16F3N2O5P MolecularWeight: 332.213411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)C(F)(F)F)OP(=O)([O-])[O-].[NH4+].[NH4+]

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)C(F)(F)F)OP(=O)([O-])[O-].[NH4+].[NH4+]

InChI

InChI=1S/C10H10F3O5P.2H3N/c11-10(12,13)9(14)6-3-7-1-4-8(5-2-7)18-19(15,16)17;;/h1-2,4-5H,3,6H2,(H2,15,16,17);2*1H3