[(5-imidazol-1-yl-2,4-dinitro-phenyl)amino]methylphosphonic acid

Systemtic Name: [(5-imidazol-1-yl-2,4-dinitro-phenyl)amino]methylphosphonic acid Openeye Name: (5-imidazol-1-yl-2,4-dinitro-anilino)methylphosphonic acid CAS Name: [5-(1-imidazolyl)-2,4-dinitroanilino]methylphosphonic acid IUPAC Name: (5-imidazol-1-yl-2,4-dinitroanilino)methylphosphonic acid Traditional Name: (5-imidazol-1-yl-2,4-dinitro-anilino)methylphosphonic acid Formula: C10H10N5O7P MolecularWeight: 343.189461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NCP(=O)(O)O

Isomeric SMILES

C1=CN(C=N1)C2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NCP(=O)(O)O

InChI

InChI=1S/C10H10N5O7P/c16-14(17)8-4-10(15(18)19)9(13-2-1-11-5-13)3-7(8)12-6-23(20,21)22/h1-5,12H,6H2,(H2,20,21,22)