2-ethyl-5-[[4-nitro-2-(phenylmethyl)phenoxy]methyl]-1,3,4-oxadiazole

Systemtic Name: 2-ethyl-5-[[4-nitro-2-(phenylmethyl)phenoxy]methyl]-1,3,4-oxadiazole Openeye Name: 2-[(2-benzyl-4-nitro-phenoxy)methyl]-5-ethyl-1,3,4-oxadiazole CAS Name: 2-ethyl-5-[[4-nitro-2-(phenylmethyl)phenoxy]methyl]-1,3,4-oxadiazole IUPAC Name: 2-[(2-benzyl-4-nitrophenoxy)methyl]-5-ethyl-1,3,4-oxadiazole Traditional Name: 2-[(2-benzyl-4-nitro-phenoxy)methyl]-5-ethyl-1,3,4-oxadiazole Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(O1)COC2=C(C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CCC1=NN=C(O1)COC2=C(C=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O4/c1-2-17-19-20-18(25-17)12-24-16-9-8-15(21(22)23)11-14(16)10-13-6-4-3-5-7-13/h3-9,11H,2,10,12H2,1H3