5-butyl-3-(4-chloranyl-3-nitro-phenyl)-1,2,4-oxadiazole

Systemtic Name: 5-butyl-3-(4-chloranyl-3-nitro-phenyl)-1,2,4-oxadiazole Openeye Name: 5-butyl-3-(4-chloro-3-nitro-phenyl)-1,2,4-oxadiazole CAS Name: 5-butyl-3-(4-chloro-3-nitrophenyl)-1,2,4-oxadiazole IUPAC Name: 5-butyl-3-(4-chloro-3-nitrophenyl)-1,2,4-oxadiazole Traditional Name: 5-butyl-3-(4-chloro-3-nitro-phenyl)-1,2,4-oxadiazole Formula: C12H12ClN3O3 MolecularWeight: 281.69498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NO1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NC(=NO1)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O3/c1-2-3-4-11-14-12(15-19-11)8-5-6-9(13)10(7-8)16(17)18/h5-7H,2-4H2,1H3