4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-2-one

Systemtic Name: 4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-2-one Openeye Name: 4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-2-one CAS Name: 4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-piperazinone IUPAC Name: 4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-2-one Traditional Name: 4-[[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-2-one Formula: C13H13N5O4 MolecularWeight: 303.27342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)CC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O4/c19-11-7-17(5-4-14-11)8-12-15-13(16-22-12)9-2-1-3-10(6-9)18(20)21/h1-3,6H,4-5,7-8H2,(H,14,19)