2-[(4-azido-2-nitro-phenyl)amino]ethyl phosphono hydrogen phosphate

Systemtic Name: 2-[(4-azido-2-nitro-phenyl)amino]ethyl phosphono hydrogen phosphate Openeye Name: 2-(4-azido-2-nitro-anilino)ethyl phosphono hydrogen phosphate CAS Name: 2-(4-azido-2-nitroanilino)ethyl phosphono hydrogen phosphate IUPAC Name: 2-(4-azido-2-nitroanilino)ethyl phosphono hydrogen phosphate Traditional Name: 2-(4-azido-2-nitro-anilino)ethyl phosphono hydrogen phosphate Formula: C8H11N5O9P2 MolecularWeight: 383.148562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCOP(=O)(O)OP(=O)(O)O

Isomeric SMILES

C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])NCCOP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C8H11N5O9P2/c9-12-11-6-1-2-7(8(5-6)13(14)15)10-3-4-21-24(19,20)22-23(16,17)18/h1-2,5,10H,3-4H2,(H,19,20)(H2,16,17,18)