3-[1-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-3-methoxy-propan-2-yl]oxy-4-methyl-1,2,5-oxadiazole

Systemtic Name: 3-[1-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]-3-methoxy-propan-2-yl]oxy-4-methyl-1,2,5-oxadiazole Openeye Name: 3-[1-[[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]methyl]-2-methoxy-ethoxy]-4-methyl-1,2,5-oxadiazole CAS Name: 3-[1-[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-3-methoxypropan-2-yl]oxy-4-methyl-1,2,5-oxadiazole IUPAC Name: 3-[1-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]-3-methoxypropan-2-yl]oxy-4-methyl-1,2,5-oxadiazole Traditional Name: 3-[1-[[4-(2-chloro-4-nitro-phenyl)piperazino]methyl]-2-methoxy-ethoxy]-4-methyl-furazan Formula: C17H22ClN5O5 MolecularWeight: 411.84008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NON=C1OC(CN2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)COC

Isomeric SMILES

CC1=NON=C1OC(CN2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)COC

InChI

InChI=1S/C17H22ClN5O5/c1-12-17(20-28-19-12)27-14(11-26-2)10-21-5-7-22(8-6-21)16-4-3-13(23(24)25)9-15(16)18/h3-4,9,14H,5-8,10-11H2,1-2H3