2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1,3,4-oxadiazole Openeye Name: 2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1,3,4-oxadiazole CAS Name: 2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1,3,4-oxadiazole IUPAC Name: 2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1,3,4-oxadiazole Traditional Name: 2-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1,3,4-oxadiazole Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC3=CC=C(C=C3)C4=NN=CO4)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC3=CC=C(C=C3)C4=NN=CO4)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6/c21-20(22)14-5-12-7-23-10-26-16(12)13(6-14)8-24-15-3-1-11(2-4-15)17-19-18-9-25-17/h1-6,9H,7-8,10H2