2-[[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]amino]-5-nitro-benzonitrile CAS Name: 2-[[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]amino]-5-nitrobenzonitrile IUPAC Name: 2-[[5-(2-hydroxyethylamino)-4-nitro-2,1,3-benzoxadiazol-7-yl]amino]-5-nitrobenzonitrile Traditional Name: 2-[[6-(2-hydroxyethylamino)-7-nitro-benzofurazan-4-yl]amino]-5-nitro-benzonitrile Formula: C15H11N7O6 MolecularWeight: 385.29114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCO

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCO

InChI

InChI=1S/C15H11N7O6/c16-7-8-5-9(21(24)25)1-2-10(8)18-11-6-12(17-3-4-23)15(22(26)27)14-13(11)19-28-20-14/h1-2,5-6,17-18,23H,3-4H2