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

Systemtic Name: 5-[(4-methoxy-2-nitro-phenoxy)methyl]-3-(phenylmethyl)-1,2,4-oxadiazole Openeye Name: 3-benzyl-5-[(4-methoxy-2-nitro-phenoxy)methyl]-1,2,4-oxadiazole CAS Name: 5-[(4-methoxy-2-nitrophenoxy)methyl]-3-(phenylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-benzyl-5-[(4-methoxy-2-nitrophenoxy)methyl]-1,2,4-oxadiazole Traditional Name: 3-benzyl-5-[(4-methoxy-2-nitro-phenoxy)methyl]-1,2,4-oxadiazole Formula: C17H15N3O5 MolecularWeight: 341.3181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2=NC(=NO2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OCC2=NC(=NO2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O5/c1-23-13-7-8-15(14(10-13)20(21)22)24-11-17-18-16(19-25-17)9-12-5-3-2-4-6-12/h2-8,10H,9,11H2,1H3