beryllium [3-[(2,4-dinitrophenyl)amino]propoxy-oxidanyl-phosphoryl] hydrogen phosphate trifluoride

Systemtic Name: beryllium [3-[(2,4-dinitrophenyl)amino]propoxy-oxidanyl-phosphoryl] hydrogen phosphate trifluoride Openeye Name: beryllium [3-(2,4-dinitroanilino)propoxy-hydroxy-phosphoryl] hydrogen phosphate trifluoride CAS Name: beryllium [3-(2,4-dinitroanilino)propoxy-hydroxyphosphoryl] hydrogen phosphate trifluoride IUPAC Name: beryllium [3-(2,4-dinitroanilino)propoxy-hydroxyphosphoryl] hydrogen phosphate trifluoride Traditional Name: beryllium [3-(2,4-dinitroanilino)propoxy-hydroxy-phosphoryl] hydrogen phosphate trifluoride Formula: C9H12BeF3N3O11P2-2 MolecularWeight: 466.159994

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Descriptors Computed from Structure

Canonical SMILES:

[Be+2].C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCCOP(=O)(O)OP(=O)(O)[O-].[F-].[F-].[F-]

Isomeric SMILES

[Be+2].C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCCOP(=O)(O)OP(=O)(O)[O-].[F-].[F-].[F-]

InChI

InChI=1S/C9H13N3O11P2.Be.3FH/c13-11(14)7-2-3-8(9(6-7)12(15)16)10-4-1-5-22-25(20,21)23-24(17,18)19;;;;/h2-3,6,10H,1,4-5H2,(H,20,21)(H2,17,18,19);;3*1H/q;+2;;;/p-4