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

Systemtic Name: 5-[(5-methyl-2-nitro-phenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole Openeye Name: 3-isobutyl-5-[(5-methyl-2-nitro-phenoxy)methyl]-1,2,4-oxadiazole CAS Name: 5-[(5-methyl-2-nitrophenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole IUPAC Name: 5-[(5-methyl-2-nitrophenoxy)methyl]-3-(2-methylpropyl)-1,2,4-oxadiazole Traditional Name: 3-isobutyl-5-[(5-methyl-2-nitro-phenoxy)methyl]-1,2,4-oxadiazole Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC2=NC(=NO2)CC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC2=NC(=NO2)CC(C)C

InChI

InChI=1S/C14H17N3O4/c1-9(2)6-13-15-14(21-16-13)8-20-12-7-10(3)4-5-11(12)17(18)19/h4-5,7,9H,6,8H2,1-3H3