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

Systemtic Name: 3-tert-butyl-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[[4-(4-nitrophenyl)piperazino]methyl]-1,2,4-oxadiazole Formula: C17H23N5O3 MolecularWeight: 345.39622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=N1)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NOC(=N1)CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O3/c1-17(2,3)16-18-15(25-19-16)12-20-8-10-21(11-9-20)13-4-6-14(7-5-13)22(23)24/h4-7H,8-12H2,1-3H3