beryllium; 2-[(3-nitrophenyl)amino]ethyl phosphono hydrogen phosphate; trifluoride

Systemtic Name: beryllium; 2-[(3-nitrophenyl)amino]ethyl phosphono hydrogen phosphate; trifluoride Openeye Name: beryllium; 2-(3-nitroanilino)ethyl phosphono hydrogen phosphate; trifluoride CAS Name: beryllium; 2-(3-nitroanilino)ethyl phosphono hydrogen phosphate; trifluoride IUPAC Name: beryllium; 2-(3-nitroanilino)ethyl phosphono hydrogen phosphate; trifluoride Traditional Name: beryllium; 2-(3-nitroanilino)ethyl phosphono hydrogen phosphate; trifluoride Formula: C8H12BeF3N2O9P2-3 MolecularWeight: 408.143794

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Descriptors Computed from Structure

Canonical SMILES:

[Be].C1=CC(=CC(=C1)[N+](=O)[O-])NCCOP(=O)(O)OP(=O)(O)O.[F-].[F-].[F-]

Isomeric SMILES

[Be].C1=CC(=CC(=C1)[N+](=O)[O-])NCCOP(=O)(O)OP(=O)(O)O.[F-].[F-].[F-]

InChI

InChI=1S/C8H12N2O9P2.Be.3FH/c11-10(12)8-3-1-2-7(6-8)9-4-5-18-21(16,17)19-20(13,14)15;;;;/h1-3,6,9H,4-5H2,(H,16,17)(H2,13,14,15);;3*1H/p-3