3-ethyl-5-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-nitro-phenyl]-1,2,4-oxadiazole

Systemtic Name: 3-ethyl-5-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-nitro-phenyl]-1,2,4-oxadiazole Openeye Name: 3-ethyl-5-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-nitro-phenyl]-1,2,4-oxadiazole CAS Name: 3-ethyl-5-[4-[4-(4-methoxyphenyl)-1-piperazinyl]-3-nitrophenyl]-1,2,4-oxadiazole IUPAC Name: 3-ethyl-5-[4-[4-(4-methoxyphenyl)piperazin-1-yl]-3-nitrophenyl]-1,2,4-oxadiazole Traditional Name: 3-ethyl-5-[4-[4-(4-methoxyphenyl)piperazino]-3-nitro-phenyl]-1,2,4-oxadiazole Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=N1)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CCC1=NOC(=N1)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O4/c1-3-20-22-21(30-23-20)15-4-9-18(19(14-15)26(27)28)25-12-10-24(11-13-25)16-5-7-17(29-2)8-6-16/h4-9,14H,3,10-13H2,1-2H3