3-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]-5-(2-methylpropyl)-1,2,4-oxadiazole

Systemtic Name: 3-[(6-methyl-2-nitro-pyridin-3-yl)oxymethyl]-5-(2-methylpropyl)-1,2,4-oxadiazole Openeye Name: 5-isobutyl-3-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]-1,2,4-oxadiazole CAS Name: 3-[(6-methyl-2-nitro-3-pyridinyl)oxymethyl]-5-(2-methylpropyl)-1,2,4-oxadiazole IUPAC Name: 3-[(6-methyl-2-nitropyridin-3-yl)oxymethyl]-5-(2-methylpropyl)-1,2,4-oxadiazole Traditional Name: 5-isobutyl-3-[(6-methyl-2-nitro-3-pyridyl)oxymethyl]-1,2,4-oxadiazole Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OCC2=NOC(=N2)CC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)OCC2=NOC(=N2)CC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4/c1-8(2)6-12-15-11(16-21-12)7-20-10-5-4-9(3)14-13(10)17(18)19/h4-5,8H,6-7H2,1-3H3