N7-(2-methoxy-5-nitro-phenyl)-4-nitro-N5-pyridin-2-yl-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: N7-(2-methoxy-5-nitro-phenyl)-4-nitro-N5-pyridin-2-yl-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N7-(2-methoxy-5-nitro-phenyl)-4-nitro-N5-(2-pyridyl)-2,1,3-benzoxadiazole-5,7-diamine CAS Name: N7-(2-methoxy-5-nitrophenyl)-4-nitro-N5-(2-pyridinyl)-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 7-N-(2-methoxy-5-nitrophenyl)-4-nitro-5-N-pyridin-2-yl-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: [7-(2-methoxy-5-nitro-anilino)-4-nitro-benzofurazan-5-yl]-(2-pyridyl)amine Formula: C18H13N7O6 MolecularWeight: 423.33912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=CC=CC=N4

InChI

InChI=1S/C18H13N7O6/c1-30-14-6-5-10(24(26)27)8-11(14)20-12-9-13(21-15-4-2-3-7-19-15)18(25(28)29)17-16(12)22-31-23-17/h2-9,20H,1H3,(H,19,21)