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

Systemtic Name: 3-(4-ethoxyphenyl)-5-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-ethoxyphenyl)-5-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-ethoxyphenyl)-5-[[4-(2-nitrophenyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-ethoxyphenyl)-5-[[4-(2-nitrophenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-[[4-(2-nitrophenyl)piperazino]methyl]-3-p-phenetyl-1,2,4-oxadiazole Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O4/c1-2-29-17-9-7-16(8-10-17)21-22-20(30-23-21)15-24-11-13-25(14-12-24)18-5-3-4-6-19(18)26(27)28/h3-10H,2,11-15H2,1H3