beryllium 2-[(4-nitrophenyl)amino]ethyl phosphono hydrogen phosphate trifluoride

Systemtic Name: beryllium 2-[(4-nitrophenyl)amino]ethyl phosphono hydrogen phosphate trifluoride Openeye Name: beryllium 2-(4-nitroanilino)ethyl phosphono hydrogen phosphate trifluoride CAS Name: beryllium 2-(4-nitroanilino)ethyl phosphono hydrogen phosphate trifluoride IUPAC Name: beryllium 2-(4-nitroanilino)ethyl phosphono hydrogen phosphate trifluoride Traditional Name: beryllium 2-(4-nitroanilino)ethyl phosphono hydrogen phosphate trifluoride Formula: C8H12BeF3N2O9P2- MolecularWeight: 408.143794

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Descriptors Computed from Structure

Canonical SMILES:

[Be+2].C1=CC(=CC=C1NCCOP(=O)(O)OP(=O)(O)O)[N+](=O)[O-].[F-].[F-].[F-]

Isomeric SMILES

[Be+2].C1=CC(=CC=C1NCCOP(=O)(O)OP(=O)(O)O)[N+](=O)[O-].[F-].[F-].[F-]

InChI

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