4-(1H-imidazol-5-yl)-2,6-dinitro-aniline

Systemtic Name: 4-(1H-imidazol-5-yl)-2,6-dinitro-aniline Openeye Name: 4-(1H-imidazol-5-yl)-2,6-dinitro-aniline CAS Name: 4-(1H-imidazol-5-yl)-2,6-dinitroaniline IUPAC Name: 4-(1H-imidazol-5-yl)-2,6-dinitroaniline Traditional Name: [4-(1H-imidazol-5-yl)-2,6-dinitro-phenyl]amine Formula: C9H7N5O4 MolecularWeight: 249.18298

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C2=CN=CN2

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])N)[N+](=O)[O-])C2=CN=CN2

InChI

InChI=1S/C9H7N5O4/c10-9-7(13(15)16)1-5(2-8(9)14(17)18)6-3-11-4-12-6/h1-4H,10H2,(H,11,12)