5-tert-butyl-3-[(4-nitrophenyl)methyl]-1,2,4-oxadiazole

Systemtic Name: 5-tert-butyl-3-[(4-nitrophenyl)methyl]-1,2,4-oxadiazole Openeye Name: 5-tert-butyl-3-[(4-nitrophenyl)methyl]-1,2,4-oxadiazole CAS Name: 5-tert-butyl-3-[(4-nitrophenyl)methyl]-1,2,4-oxadiazole IUPAC Name: 5-tert-butyl-3-[(4-nitrophenyl)methyl]-1,2,4-oxadiazole Traditional Name: 5-tert-butyl-3-(4-nitrobenzyl)-1,2,4-oxadiazole Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NO1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=NC(=NO1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O3/c1-13(2,3)12-14-11(15-19-12)8-9-4-6-10(7-5-9)16(17)18/h4-7H,8H2,1-3H3