5-[(2-bromanyl-4-ethyl-phenoxy)methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2-bromanyl-4-ethyl-phenoxy)methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole Openeye Name: 5-[(2-bromo-4-ethyl-phenoxy)methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole CAS Name: 5-[(2-bromo-4-ethylphenoxy)methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2-bromo-4-ethylphenoxy)methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole Traditional Name: 5-[(2-bromo-4-ethyl-phenoxy)methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H14BrN3O4/c1-2-11-3-8-15(14(18)9-11)24-10-16-19-17(20-25-16)12-4-6-13(7-5-12)21(22)23/h3-9H,2,10H2,1H3