5-tert-butyl-3-(2-chloranyl-4-nitro-phenyl)-1,3,4-oxadiazol-2-one

Systemtic Name: 5-tert-butyl-3-(2-chloranyl-4-nitro-phenyl)-1,3,4-oxadiazol-2-one Openeye Name: 5-tert-butyl-3-(2-chloro-4-nitro-phenyl)-1,3,4-oxadiazol-2-one CAS Name: 5-tert-butyl-3-(2-chloro-4-nitrophenyl)-1,3,4-oxadiazol-2-one IUPAC Name: 5-tert-butyl-3-(2-chloro-4-nitrophenyl)-1,3,4-oxadiazol-2-one Traditional Name: 5-tert-butyl-3-(2-chloro-4-nitro-phenyl)-1,3,4-oxadiazol-2-one Formula: C12H12ClN3O4 MolecularWeight: 297.69438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)O1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)O1)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H12ClN3O4/c1-12(2,3)10-14-15(11(17)20-10)9-5-4-7(16(18)19)6-8(9)13/h4-6H,1-3H3