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

Systemtic Name: 5-tert-butyl-3-(4-chloranyl-2-nitro-phenyl)-1,3,4-oxadiazol-2-one Openeye Name: 5-tert-butyl-3-(4-chloro-2-nitro-phenyl)-1,3,4-oxadiazol-2-one CAS Name: 5-tert-butyl-3-(4-chloro-2-nitrophenyl)-1,3,4-oxadiazol-2-one IUPAC Name: 5-tert-butyl-3-(4-chloro-2-nitrophenyl)-1,3,4-oxadiazol-2-one Traditional Name: 5-tert-butyl-3-(4-chloro-2-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)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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