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

Systemtic Name: 3-tert-butyl-5-[1-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[1-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[1-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]ethyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[1-[4-(4-chloro-2-nitro-phenyl)piperazino]ethyl]-1,2,4-oxadiazole Formula: C18H24ClN5O3 MolecularWeight: 393.86786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C(C)(C)C)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NC(=NO1)C(C)(C)C)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H24ClN5O3/c1-12(16-20-17(21-27-16)18(2,3)4)22-7-9-23(10-8-22)14-6-5-13(19)11-15(14)24(25)26/h5-6,11-12H,7-10H2,1-4H3