triazanium [oxidanidyl-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxy-phosphoryl] phosphate

Systemtic Name: triazanium [oxidanidyl-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxy-phosphoryl] phosphate Openeye Name: triammonium [oxido-(4-oxo-2-phenyl-chromen-3-yl)oxy-phosphoryl] phosphate CAS Name: triammonium [oxido-[(4-oxo-2-phenyl-1-benzopyran-3-yl)oxy]phosphoryl] phosphate IUPAC Name: triazanium [oxido-(4-oxo-2-phenylchromen-3-yl)oxyphosphoryl] phosphate Traditional Name: triammonium [(4-keto-2-phenyl-chromen-3-yl)oxy-oxido-phosphoryl] phosphate Formula: C15H21N3O9P2 MolecularWeight: 449.289462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OP(=O)([O-])OP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OP(=O)([O-])OP(=O)([O-])[O-].[NH4+].[NH4+].[NH4+]

InChI

InChI=1S/C15H12O9P2.3H3N/c16-13-11-8-4-5-9-12(11)22-14(10-6-2-1-3-7-10)15(13)23-26(20,21)24-25(17,18)19;;;/h1-9H,(H,20,21)(H2,17,18,19);3*1H3