2-[4-(benzotriazol-1-yl)-3-nitro-phenyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[4-(benzotriazol-1-yl)-3-nitro-phenyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[4-(benzotriazol-1-yl)-3-nitro-phenyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[4-(1-benzotriazolyl)-3-nitrophenyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[4-(benzotriazol-1-yl)-3-nitrophenyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[4-(benzotriazol-1-yl)-3-nitro-phenyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Formula: C20H11N7O5 MolecularWeight: 429.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C=C3)C4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C=C3)C4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H11N7O5/c28-26(29)14-8-5-12(6-9-14)19-22-23-20(32-19)13-7-10-17(18(11-13)27(30)31)25-16-4-2-1-3-15(16)21-24-25/h1-11H