2-(2-methylphenyl)-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole

Systemtic Name: 2-(2-methylphenyl)-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole Openeye Name: 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-5-(o-tolyl)-1,3,4-oxadiazole CAS Name: 2-(2-methylphenyl)-5-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,3,4-oxadiazole IUPAC Name: 2-(2-methylphenyl)-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,3,4-oxadiazole Traditional Name: 2-[[4-(4-nitrophenyl)piperazino]methyl]-5-(o-tolyl)-1,3,4-oxadiazole Formula: C20H21N5O3 MolecularWeight: 379.41244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(O2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(O2)CN3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c1-15-4-2-3-5-18(15)20-22-21-19(28-20)14-23-10-12-24(13-11-23)16-6-8-17(9-7-16)25(26)27/h2-9H,10-14H2,1H3