1-[2-(1,3-benzodioxol-5-yl)-5-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)-5-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)-5-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone CAS Name: 1-[2-(1,3-benzodioxol-5-yl)-5-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)-5-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Traditional Name: 1-[2-(1,3-benzodioxol-5-yl)-5-(3-nitrophenyl)-2H-1,3,4-oxadiazol-3-yl]ethanone Formula: C17H13N3O6 MolecularWeight: 355.30162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)N1C(OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H13N3O6/c1-10(21)19-17(12-5-6-14-15(8-12)25-9-24-14)26-16(18-19)11-3-2-4-13(7-11)20(22)23/h2-8,17H,9H2,1H3